C44H53FN7O8 Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N, N-bis(1-methyl ethyl)phosphoramidite] (ACI)

sehlahisoa

C44H53FN7O8 Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N, N-bis(1-methyl ethyl)phosphoramidite] (ACI)

Lintlha tsa Motheo:


Lintlha tsa Sehlahisoa

Li-tag tsa Sehlahisoa

Tlhaloso ea Lintho

Nomoro ea Registry ea CAS

144089-97-4

Lintho Tsa Bohlokoa Tsa 'Mele Boleng Boemo
Boima ba Molek'hule 857.91 -
pKa (E boletsoeng esale pele) 9.16±0.20 Mocheso o nang le Asiti ka ho Fetisisa: 25 °C

Mabitso a Mang le Litlhahiso

Canonical POSISO

N#CCCOP(OC1C(F)C(OC1COC(C=2C=CC=CC2)(C3=CC=C(OC)C=C3)C4=CC=C(OC)C=C4)N5C= NC=6C (=O)N=C(NC(=O)C(C)C)NC65)N(C(C) C)C(C)C

Isomeric SOSOA

C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](F)[C@@ H](O1)N2C3=C(N=C2)C(=O)N=C(NC(C(C)C)=O)N3)(C4=CC=C(OC)C =C4)(C5 =CC=C(OC)C=C5)C6=CC=CC=C6

InChi

InChI= 1S/C44H53FN7O8P/c1-27(2)40(53)49-43-48-39-37(41(54)50-43)47-26-51(39)42-36(45)38( 60-61(58-24-12-23-46)52(28(3)4)29(5) 6)35(59-42)25-57-44(30-13-10-9-11- 14-30,31-15-19-33(55-7)20-16-31)32-17-21-34(56-8)22-18-32/h9-11,13-22,26- 29,35-36,38,42H,12, 24-25H2,1-8H3,(H2,48,49,50,53,54)/t35-,36-,38-,42-,61?/m1 /s1

Senotlolo sa InChi

KJFUMXZZVYMQEU-AOCJBPQJSA-N

1 Lebitso le Leng la Ntho ena

Guanosine, 5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -deoxy-2′ -fluoro-N-(2-methyl-1-oxopropyl)-, 3′ - [2-cyanoethyl bis(1-methyl ethyl)phosphoramidite] (9CI)

Thepa e boletsoeng esale pele

Thepa e teng
Likokoana-hloko
Lik'hemik'hale
Lipinski
Sebopeho se Amanang

Likokoana-hloko

Thepa Boleng Boemo Mohloli
Bioconcentration Factor 298 pH 1;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 6350 pH 2;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 57800 pH 3;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.76 x 105 pH 4;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 2.21 x 105 pH 5;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 2.26 x 105 pH 6;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 2.24 x 105 pH 7;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 2.03 x 105 pH 8;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 1.04 x 105 pH 9;Mocheso: 25 °C (1) ACD
Bioconcentration Factor 19300 pH 10;Mocheso: 25 °C (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lik'hemik'hale

Mohloli oa Boemo ba Boleng ba Thepa
Koc 312 pH 1;Mocheso: 25 °C (1) ACD
Koc 6630 pH 2;Mocheso: 25 °C (1) ACD
Koc 60400 pH 3;Mocheso: 25 °C (1) ACD
Koc 1.84 x 105 pH 4;Mocheso: 25 °C (1) ACD
Koc 2.31 x 105 pH 5;Mocheso: 25 °C (1) ACD
Koc 2.37 x 105 pH 6;Mocheso: 25 °C (1) ACD
Koc 2.35 x 105 pH 7;Mocheso: 25 °C (1) ACD
Koc 2.12 x 105 pH 8;Mocheso: 25 °C (1) ACD
Koc 1.08 x 105 pH 9;Mocheso: 25 °C (1) ACD
Koc 20200 pH 10;Mocheso: 25 °C (1) ACD
logD 4.47 pH 1;Mocheso: 25 °C (1) ACD
logD 5.80 pH 2;Mocheso: 25 °C (1) ACD

 

Thepa Boleng Boemo Mohloli
logD 6.76 pH 3;Mocheso: 25 °C (1) ACD
logD 7.24 pH 4;Mocheso: 25 °C (1) ACD
logD 7.34 pH 5;Mocheso: 25 °C (1) ACD
logD 7.35 pH 6;Mocheso: 25 °C (1) ACD
logD 7.35 pH 7;Mocheso: 25 °C (1) ACD
logD 7.30 pH 8;Mocheso: 25 °C (1) ACD
logD 7.01 pH 9;Mocheso: 25 °C (1) ACD
logD 6.28 pH 10;Mocheso: 25 °C (1) ACD
logP 7.351±0.713 Mocheso: 25 °C (1) ACD
Mass Intrinsic Sollubility 3.0 x 10-5 g/L Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 0.022 g/L pH 1;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 1.0 x 10-3 g/L pH 2;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 1.2 x 10-4 g/L pH 3;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.9 x 10-5 g/L pH 4;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.1 x 10-5 g/L pH 5;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.0 x 10-5 g/L pH 6;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.0 x 10-5 g/L pH 7;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.3 x 10-5 g/L pH 8;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 6.5 x 10-5 g/L pH 9;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.5 x 10-4 g/L pH 10;Mocheso: 25 °C (1) ACD
Ho qhibiliha ka bongata 3.0 x 10-5 g/L Metsi a sa tsitsang pH 7.00;Mocheso: 25 °C (1) ACD
Molar Intrinsic Solubility 3.5 x 10-8 mol/L Mocheso: 25 °C (1) ACD
Molar Solubility 2.6 x 10-5 mol/L pH 1;Mocheso: 25 °C (1) ACD
Molar Solubility 1.2 x 10-6 mol/L pH 2;Mocheso: 25 °C (1) ACD
Molar Solubility 1.4 x 10-7 mol/L pH 3;Mocheso: 25 °C (1) ACD
Molar Solubility 4.5 x 10-8 mol/L pH 4;Mocheso: 25 °C (1) ACD
Molar Solubility 3.6 x 10-8 mol/L pH 5;Mocheso: 25 °C (1) ACD
Molar Solubility 3.5 x 10-8 mol/L pH 6;Mocheso: 25 °C (1) ACD
Molar Solubility 3.5 x 10-8 mol/L pH 7;Mocheso: 25 °C (1) ACD
Molar Solubility 3.9 x 10-8 mol/L pH 8;Mocheso: 25 °C (1) ACD
Molar Solubility 7.6 x 10-8 mol/L pH 9;Mocheso: 25 °C (1) ACD
Molar Solubility 4.1 x 10-7 mol/L pH 10;Mocheso: 25 °C (1) ACD

 

Thepa Boleng Boemo Mohloli
Molar Solubility 3.5 x 10-8 mol/L Metsi a sa tsitsang pH 7.00;Mocheso: 25 °C (1) ACD
Boima ba Molek'hule 857.91    
pKa 9.16±0.20 Mocheso o nang le Asiti ka ho Fetisisa: 25 °C (1) ACD
pKa 3.45±0,70 Mocheso ka ho Fetisisa oa Motheo: 25 °C (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Sebopeho se Amanang

Thepa Boleng Mohloli oa Boemo
Sebaka sa Polar Surface 184 A2 (1) ACD

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Thepa Boleng Boemo Mohloli
Li-Bonds tse ka fetolehang ka bolokolohi 18   (1) ACD
H Ba amohelang 15   (1) ACD
H Bafani 2   (1) ACD
H Kakaretso ea Mofani/Moamoheli 17   (1) ACD
logP 7.351±0.713 Mocheso: 25 °C (1) ACD
Boima ba Molek'hule 857.91    

(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)


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