N-Benzoyl-5'-O-[bis(4-methoxyphenyl)(phenyl)methyl]-3'-O-[(2-cyanoethoxy)(diisopropylamino)phosphino]-2'-O-methyladenosine（CAS号：110782-31-5）

N-苯甲酰基-5'-O-(4,4-二甲氧基三苯甲基)-2'-O-甲基腺苷-3'-(2-氰基乙基-N,N-二异丙基)亚磷酰胺

基本信息

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CAS号

110782-31-5

分子式

C48H54N7O8P

分子量

17.03 g/mol

化学分类

基础化工原料有机化学品羧酸类

基础化工原料有机化学品醚类

基础化工原料有机化学品腈类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品染料和颜料有机染料

精细化工产品表面活性剂阴离子表面活性剂

农用化学品农药杀虫剂

实验室化学品科研化学品生化试剂

基本物理性质

熔点

93-95°C

溶解度

Acetonitrile (Sparingly), DMSO (Slightly), Methanol (Slightly)

SMILES

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CC(C)N(C(C)C)P(OCCC#N)OC1C(OC(C1OC)N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC

InChI

InChI=1S/C48H54N7O8P/c1-32(2)55(33(3)4)64(61-28-14-27-49)63-42-40(62-47(43(42)59-7)54-31-52-41-44(50-30-51-45(41)54)53-46(56)34-15-10-8-11-16-34)29-60-48(35-17-12-9-13-18-35,36-19-23-38(57-5)24-20-36)37-21-25-39(58-6)26-22-37/h8-13,15-26,30-33,40,42-43,47H,14,28-29H2,1-7H3,(H,50,51,53,56)/t40-,42-,43-,47-,64?/m1/s1

InChIKey

AZCGOTUYEPXHMJ-PSVHYZMASA-N

LogP

0.16199999999999998

拓扑极性表面积

35.0 Å²

氢键供体/受体

3 / 1

复杂度

1430

安全信息

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危险说明

H302 吞咽有害
急性毒性-经口

H315 造成皮肤刺激
皮肤腐蚀/刺激

H319 造成严重眼刺激
严重眼损伤/眼刺激

H335 可能造成呼吸道刺激
特定目标器官毒性-单次接触；呼吸道刺激

同义词与引用数据

英文

(2R,3R,4R,5R)-5-(6-Benzamido-9H-purin-9-yl)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-methoxytetrahydrofuran-3-yl(2-cyanoethyl)diisopropylphosphoramidite
C71369
2'-OMe-A(Bz) Phosphoramidite
N-Benzoyl-5'-O-[bis(4-methoxyphenyl)(phenyl)methyl]-3'-O-[(2-cyanoethoxy)(diisopropylamino)phosphino]-2'-O-methyladenosine
2'-O-Methyl-rA(N-Bz)phosphoramidite
PD156728
N-{9-[(2R,3R,4R,5R)-5-{[BIS(4-METHOXYPHENYL)(PHENYL)METHOXY]METHYL}-4-{[(2-CYANOETHOXY)(DIISOPROPYLAMINO)PHOSPHANYL]OXY}-3-METHOXYOXOLAN-2-YL]PURIN-6-YL}BENZAMIDE
AS-75292
(2R,3R,4R,5R)-5-(6-Benzamido-9H-purin-9-yl)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-methoxytetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite
AKOS016003786
5'-O-DMT-2'-OMe-Benzoyl-Adenosine-CE Phosphoramidite
DMT-2'O-Methyl-rA(bz) Phosphoramidite, configured for MerMade
N-[9-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-3-methoxyoxolan-2-yl]purin-6-yl]benzamide
CS-0159227
HY-138580
N-Benzoyl-5'-O-[bis(4-methoxyphenyl)(phenyl)methyl]-3'-O-{(2-cyanoethoxy)[di(propan-2-yl)amino]phosphanyl}-2'-O-methyladenosine
DMT-2'O-Methyl-rA(bz) Phosphoramidite
DMT-2'O-Methyl-rA(bz) Phosphoramidite, configured for (??KTA(R) and OligoPilot(R)), configured for ABI
SCHEMBL668595
DMT-2'-O-methyl-rA(Bz) Phosphoramidite
N-{9-[(2R,3R,4R,5R)-5-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-({[bis(propan-2-yl)amino](2-cyanoethoxy)phosphanyl}oxy)-3-methoxyoxolan-2-yl]-9H-purin-6-yl}benzamide
J-700069
N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-O-methyladenosine-3'-(2-cyanoethyl diisopropylphosphoramidite)
DMT-2'O-Methyl-rA(bz) Phosphoramidite, configured for ??KTA(R) and OligoPilot(R)
DMT-2'O-Methyl-rA(bz) Phosphoramidite, configured for ABI
C48H54N7O8P
DMT-2'O-Methyl-rA(bz) Phosphoramidite;(2R,3R,4R,5R)-5-(6-Benzamido-9H-purin-9-yl)-2-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-methoxytetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite
BP-28834
DTXSID60551649
N-Benzoyl-5'-O-(4,4-dimethoxytrityl)-2'-O-methyladenosine-3'-(2-cyanoethyl-N,N-diisopropyl)phosphoramidite
5'-O-DMT-2'-O-Me-A(bz) phosphoramidite