C41H43N3O9 Cytidine, N-benzoyl-5′-O--[bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)-5-methyl- (9CI, ACI) H335, H319, H315

mankhwala

C41H43N3O9 Cytidine, N-benzoyl-5′-O--[bis(4-methoxyphenyl)phenylmethyl]-2′-O- (2-methoxyethyl)-5-methyl- (9CI, ACI) H335, H319, H315

Zambiri Zoyambira:


Tsatanetsatane wa Zamalonda

Zolemba Zamalonda

Thupi katundu

Zofunika Zathupi Mtengo Mkhalidwe
Kulemera kwa Maselo 721.80 -
Melting Point (Zoyeserera) 107-110 ° C -
Kachulukidwe (Zonenedweratu) 1.26±0.1 g/cm3 Kutentha: 20 ° C;Press: 760 Torr
pKa (Zonenedweratu) 8.60±0.40 Kutentha Kwambiri kwa Acid: 25 ° C

Mayina Ena ndi Zizindikiritso

Canonical AMAmwetulira O=C1N=C(NC(=O)C=2C=CC=CC2)C(=CN1C3OC(COC(C=4C=CC=CC=CC4)(C5=CC=C(OC)C=C5)C6 =CC=C(OC)C=C6)C(O)C3OCCOC)C
Isomeric AMAmwetulira
C(OC[C@H]1O[C@H]([C@H](OCCOC)[C@@H]1O)N2C(=O)N=C(NC(=O)C3=CC=CC =C3)C(C)=C2)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5) C6=CC=CC=C6
InChi
InChI=1S/C41H43N3O9/c1-27-25-44(40(47)43-37(27)42-38(46)28-11-7-5-8-12-28)39-36(51- 24-23-48-2)35(45)34(53-39)26-52-41(29-13)
-9-6-10-14-29,30-15-19-32(49-3)20-16-30)31-17-21-33(50-4)22-18-31/h5-22 ,25,34-36,39,45H,23-24,26H2,1-4H3,(H,42,43,46,47)/t34-,3 5-,36-,39-/m1/s1
InChi Key
BYSCLUAIKFEFAH-LZURGKRNSA-N
23 Maina ena a chinthu ichi
N-Benzoyl-5'-O--[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methoxyethyl)-5-methylcytidine (ACI);10: PN: WO03084478 TSAMBA: 57 amati RNA;12: PN: US20030170636 TSAMBA: 17 amati R NA;13: PN: US20030212017 TSAMBA: 19 amati R NA;14: PN: US20030

211606 TSAMBA: 19 ankati R NA;15: PN: US20040005569 TSAMBA: 22 amati R NA;16: PN: US20040006030 TSAMBA: 22 amati R NA;16: PN: US20040014048 TSAMBA: 20 amati R NA;17: PN: US20030171313 TSAMBA: 9 amati R NA;17: PN: US20040005565 TSAMBA: 17- 22 amati RNA;17: PN: US20040005570 TSAMBA: 20 amati R NA;17: PN: US20040014047 TSAMBA: 20 amati R NA;17: PN: US20040 014050 TSAMBA: 20 amati R NA;18: PN: US20030198965 TSAMBA: 19 amati R NA;18: PN: US20040014699 TSAMBA: 20 amati R NA;19: PN: US20040006029 TSAMBA: 23 amati R NA;19: PN: WO03106645 TSAMBA: 71 amati R NA;59: PN: US20030166592 TSAMBA: 15 amati RNA;6: PN: WO2005006958 TSAMBA: 62 amati R NA;83: PN: US20040171566 TSAMBA: 18 amati R NA;8: PN: WO2005007825
TSAMBA: 62 amati R NA;90: PN: US20040005707 TSAMBA: 20 amati R NA;N4-Benzoyl-2'-O-methoxyethyl-5'-O-dimethoxytrityl-5-
methylcytidine

Zoyeserera

Katundu zilipo
Kutentha

Kutentha

Katundu Mtengo Mkhalidwe Gwero
Melting Point 107-110 ° C (1) CAS

(1) Penjarla, Srishylam;Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus

Experimental Spectra

Spectra ilipo
1H NMR
13C NMR

Zonenedweratu Katundu

Katundu zilipo
Zachilengedwe
Chemical
Kuchulukana
Lipinski
Zogwirizana ndi Kapangidwe

Zachilengedwe

Katundu Mtengo Mkhalidwe Gwero
Bioconcentration Factor 291 pH 1;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 644 pH 2;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 3690 pH 3;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 15600 pH 4;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 23700 pH 5;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 24800 pH 6;Kutentha: 25 ° C (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
Bioconcentration Factor 23300 pH 7;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 14100 pH 8;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 3010 pH 9;Kutentha: 25 ° C (1) ACD
Bioconcentration Factor 558 pH 10;Kutentha: 25 ° C (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chemical

Katundu Mtengo Mkhalidwe Gwero
Koc 569 pH 1;Kutentha: 25 ° C (1) ACD
Koc 1260 pH 2;Kutentha: 25 ° C (1) ACD
Koc 7210 pH 3;Kutentha: 25 ° C (1) ACD
Koc 30400 pH 4;Kutentha: 25 ° C (1) ACD
Koc 46300 pH 5;Kutentha: 25 ° C (1) ACD
Koc 48500 pH 6;Kutentha: 25 ° C (1) ACD
Koc 45500 pH 7;Kutentha: 25 ° C (1) ACD
Koc 27500 pH 8;Kutentha: 25 ° C (1) ACD
Koc 5890 pH 9;Kutentha: 25 ° C (1) ACD
Koc 1090 pH 10;Kutentha: 25 ° C (1) ACD
logD 4.16 pH 1;Kutentha: 25 ° C (1) ACD
logD 4.50 pH 2;Kutentha: 25 ° C (1) ACD
logD 5.26 pH 3;Kutentha: 25 ° C (1) ACD
logD 5.88 pH 4;Kutentha: 25 ° C (1) ACD
logD 6.07 pH 5;Kutentha: 25 ° C (1) ACD
logD 6.09 pH 6;Kutentha: 25 ° C (1) ACD
logD 6.06 pH 7;Kutentha: 25 ° C (1) ACD
logD 5.84 pH 8;Kutentha: 25 ° C (1) ACD
logD 5.17 pH 9;Kutentha: 25 ° C (1) ACD
logD 4.44 pH 10;Kutentha: 25 ° C (1) ACD
logP 6.093±0.720 Kutentha: 25 ° C (1) ACD
Mass Intrinsic Solubility 1.3 x 10-4 g/L Kutentha: 25 ° C (1) ACD
Misa Solubility 0.011 g/L pH 1;Kutentha: 25 ° C (1) ACD
Misa Solubility 5.0 x 10-3 g/L pH 2;Kutentha: 25 ° C (1) ACD
Misa Solubility 8.7 x 10-4 g/L pH 3;Kutentha: 25 ° C (1) ACD
Misa Solubility 2.1 x 10-4 g/L pH 4;Kutentha: 25 ° C (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
Misa Solubility 1.4 x 10-4 g/L pH 5;Kutentha: 25 ° C (1) ACD
Misa Solubility 1.3 x 10-4 g/L pH 6;Kutentha: 25 ° C (1) ACD
Misa Solubility 1.4 x 10-4 g/L pH 7;Kutentha: 25 ° C (1) ACD
Misa Solubility 2.3 x 10-4 g/L pH 8;Kutentha: 25 ° C (1) ACD
Misa Solubility 1.1 x 10-3 g/L pH 9;Kutentha: 25 ° C (1) ACD
Misa Solubility 5.8 x 10-3 g/L pH 10;Kutentha: 25 ° C (1) ACD
Misa Solubility 1.4 x 10-4 g/L Madzi Osasunthika pH 6.97;Kutentha: 25 ° C (1) ACD
Molar Intrinsic Solubility 1.8 x 10-7 mol / L Kutentha: 25 ° C (1) ACD
Molar Solubility 1.5 x 10-5 mol / L pH 1;Kutentha: 25 ° C (1) ACD
Molar Solubility 6.9 x 10-6 mol / L pH 2;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.2 x 10-6 mol / L pH 3;Kutentha: 25 ° C (1) ACD
Molar Solubility 2.9 x 10-7 mol / L pH 4;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.9 x 10-7 mol / L pH 5;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.8 x 10-7 mol / L pH 6;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.9 x 10-7 mol / L pH 7;Kutentha: 25 ° C (1) ACD
Molar Solubility 3.2 x 10-7 mol / L pH 8;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.5 x 10-6 mol / L pH 9;Kutentha: 25 ° C (1) ACD
Molar Solubility 8.0 x 10-6 mol / L pH 10;Kutentha: 25 ° C (1) ACD
Molar Solubility 1.9 x 10-7 mol / L Madzi Osasunthika pH 6.97;Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 721.80    
pKa 8.60±0.40 Kutentha Kwambiri kwa Acid: 25 ° C (1) ACD
pKa 3.87±0.20 Kutentha Kwambiri Kwambiri: 25 °C (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kuchulukana

Katundu Mtengo Mkhalidwe Gwero
Kuchulukana 1.26±0.1 g/cm3 Kutentha: 20 ° C;Press: 760 Torr (1) ACD
Molar Volume 572.5±7.0cm3/mol Kutentha: 20 ° C;Press: 760 Torr (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Katundu Mtengo Mkhalidwe Gwero
Ma Bond Osinthasintha Mwaulere 15 (1) ACD

 

Katundu Mtengo Mkhalidwe Gwero
H Olandira 12   (1) ACD
H Opereka 2   (1) ACD
H Chiwerengero cha Wopereka / Wolandira 14   (1) ACD
logP 6.093±0.720 Kutentha: 25 ° C (1) ACD
Kulemera kwa Maselo 721.80    

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Zogwirizana ndi Kapangidwe

Katundu Mtengo

Mkhalidwe

Gwero
Malo a Polar Surface 137 a2 (1) ACD

(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Zoneneratu za Spectra

Spectra ilipo
1H NMR
13C NMR

Zowopsa za GHS

Kodi Chidziwitso Chowopsa Gwero
H335 Zitha kuyambitsa kupsa mtima Gulu la European Chemical Agency (ECHA) Classification&Labelling Inventory - Gulu lodziwitsidwa ndi zilembo - zidziwitso zodziwika bwino, Gulu la European Chemical Agency (ECHA) Gulu & Zolemba Zolemba - Gulu lodziwitsidwa ndi zilembo - zidziwitso zazikulu kwambiri
H319 Zimayambitsa kupsa mtima kwakukulu Gulu la European Chemical Agency (ECHA) Classification&Labelling Inventory - Gulu lodziwitsidwa ndi zilembo - zidziwitso zodziwika bwino, Gulu la European Chemical Agency (ECHA) Gulu & Zolemba Zolemba - Gulu lodziwitsidwa ndi zilembo - zidziwitso zazikulu kwambiri
H315 Zimayambitsa kuyabwa pakhungu Gulu la European Chemical Agency (ECHA) Classification&Labelling Inventory - Gulu lodziwitsidwa ndi zilembo - zidziwitso zodziwika bwino, Gulu la European Chemical Agency (ECHA) Gulu & Zolemba Zolemba - Gulu lodziwitsidwa ndi zilembo - zidziwitso zazikulu kwambiri

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