C30H29FN2O7 Uridine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′- fluoro- (9CI, ACI)
Zofunika Zathupi | Mtengo | Mkhalidwe |
Kulemera kwa Maselo | 548.56 | - |
Melting Point (Zoyeserera) | 118-120 ° C | - |
Kachulukidwe (Zonenedweratu) | 1.38±0.1 g/cm3 | Kutentha: 20 ° C; Press: 760 Torr |
pKa (Zonenedweratu) | 9.39±0.10 | Kutentha Kwambiri kwa Acid: 25 ° C |
Canonical AMAmwetulira O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2F
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](F)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChI=1S/C30H29FN2O7/c1-37-22-12-8-20(9-13-22)30(19-6-4-3-5-7 -19,21-10-14-23(38-2)15-11-21)39-18-24-27(35)26(31)28(40-24)33
-17-16-25(34)32-29(33)36/h3-17,24,26-28,35H,18H2,1-2H3,(H,32,34,36)/t24-,26- ,27-,28-/m1/s1
InChi Key
CSSFZSSZXOCCJB-YULOIDQLSA-N
1 Dzina Lina la chinthu ichi
5'-O--[Bis(4-methoxyphenyl)phenylmethyl]-2′-deoxy-2′-fluorouridine (ACI)
Katundu zilipo
Kutentha
Kutentha
Katundu | Mtengo | Mkhalidwe | Gwero |
Melting Point | 118-120 ° C | (1) CAS |
(1) Penjarla, Srishylam; Nucleosides, Nucleotides & Nucleic Acids, (2018), 37(4), 232-247, CAplus
Spectra ilipo
1H NMR
13C NMR
Katundu zilipo |
Zachilengedwe |
Chemical |
Kuchulukana |
Lipinski |
Zogwirizana ndi Kapangidwe |
Zachilengedwe
Katundu | Mtengo | Mkhalidwe | Gwero |
Bioconcentration Factor | 3580 | pH 1; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3580 | pH 2; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3580 | pH 3; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3580 | pH 4; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3580 | pH 5; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3580 | pH 6; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3570 | pH 7; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 3430 | pH 8; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 2500 | pH 9; Kutentha: 25 ° C | (1) ACD |
Bioconcentration Factor | 689 | 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 | 12200 | pH 1; Kutentha: 25 ° C | (1) ACD |
Koc | 12200 | pH 2; Kutentha: 25 ° C | (1) ACD |
Koc | 12200 | pH 3; Kutentha: 25 ° C | (1) ACD |
Koc | 12200 | pH 4; Kutentha: 25 ° C | (1) ACD |
Koc | 12200 | pH 5; Kutentha: 25 ° C | (1) ACD |
Koc | 12200 | pH 6; Kutentha: 25 ° C | (1) ACD |
Koc | 12100 | pH 7; Kutentha: 25 ° C | (1) ACD |
Koc | 11700 | pH 8; Kutentha: 25 ° C | (1) ACD |
Koc | 8480 | pH 9; Kutentha: 25 ° C | (1) ACD |
Koc | 2340 | pH 10; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 1; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 2; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 3; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 4; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 5; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 6; Kutentha: 25 ° C | (1) ACD |
logD | 4.98 | pH 7; Kutentha: 25 ° C | (1) ACD |
logD | 4.96 | pH 8; Kutentha: 25 ° C | (1) ACD |
logD | 4.82 | pH 9; Kutentha: 25 ° C | (1) ACD |
logD | 4.26 | pH 10; Kutentha: 25 ° C | (1) ACD |
logP | 4.979±0.563 | Kutentha: 25 ° C | (1) ACD |
Mass Intrinsic Solubility | 9.9 x 10-5 g/L | Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 1; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 2; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 3; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 4; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 5; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 6; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 7; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 9.9 x 10-5 g/L | pH 8; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 1.4 x 10-4 g/L | pH 9; Kutentha: 25 ° C | (1) ACD |
Misa Solubility | 5.0 x 10-4 g/L | pH 10; Kutentha: 25 ° C | (1) ACD |
Katundu | Mtengo | Mkhalidwe | Gwero |
Misa Solubility | 9.9 x 10-5 g/L | Madzi Osasunthika pH 7.00; Kutentha: 25 ° C | (1) ACD |
Molar Intrinsic Solubility | 1.8 x 10-7 mol / L | Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | pH 1; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | pH 2; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | pH 3; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | pH 4; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 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 | 1.8 x 10-7 mol / L | pH 7; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | pH 8; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 2.5 x 10-7 mol / L | pH 9; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 9.2 x 10-7 mol / L | pH 10; Kutentha: 25 ° C | (1) ACD |
Molar Solubility | 1.8 x 10-7 mol / L | Madzi Osasunthika pH 7.00; Kutentha: 25 ° C | (1) ACD |
Kulemera kwa Maselo | 548.56 | ||
pKa | 9.39±0.10 | Kutentha Kwambiri kwa Acid: 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 | 1.38±0.1 g/cm3 | Kutentha: 20 ° C; Press: 760 Torr | (1) ACD |
Molar Volume | 395.8±5.0cm3/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 | 10 | (1) ACD | |
H Olandira | 9 | (1) ACD | |
H Opereka | 2 | (1) ACD | |
H Chiwerengero cha Wopereka / Wolandira | 11 | (1) ACD | |
logP | 4.979±0.563 | Kutentha: 25 ° C | (1) ACD |
Kulemera kwa Maselo | 548.56 |
(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 | 107 a2 | (1) ACD |
(1) Owerengedwa pogwiritsa ntchito Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra ilipo
1H NMR
13C NMR