(S)-(1-苄基吡咯烷-2-基)二苯基甲醇 | 118970-95-9
(S)-(1-苄基吡咯烷-2-基)二苯基甲醇
(S)-(1-Benzylpyrrolidin-2-yl)diphenylmethanol
118970-95-9
C24H25NO
343.4614
名称和标识符
MDL |
MFCD32706455 |
InChIKey |
AZOXPIPWRDWNBA-QHCPKHFHSA-N |
Inchi |
1S/C24H25NO/c26-24(21-13-6-2-7-14-21,22-15-8-3-9-16-22)23-17-10-18-25(23)19-20-11-4-1-5-12-20/h1-9,11-16,23,26H,10,17-19H2/t23-/m0/s1 |
SMILES |
O([H])C(C1C([H])=C([H])C([H])=C([H])C=1[H])(C1C([H])=C([H])C([H])=C([H])C=1[H])[C@]1([H])C([H])([H])C([H])([H])C([H])([H])N1C([H])([H])C1C([H])=C([H])C([H])=C([H])C=1[H] |
别名信息
- 中文别名 -
- (2S)-alpha,alpha-二苯基-1-(苯基甲基)-2-吡咯烷甲醇
- (S)-(1-苄基吡咯烷-2-基)二苯基甲醇
- (2S)- Α, Α- DIPHENYL-1-(PHENYLMETHYL)-2- PYRROLIDINEMETHANOL
- 英文别名 -
- (S)-(1-Benzylpyrrolidin-2-yl)diphenylmethanol
- (2S)- Α, Α- DIPHENYL-1-(PHENYLMETHYL)-2- PYRROLIDINEMETHANOL
- (2S)-alpha,alpha-Diphenyl-1-(phenylmethyl)-2-pyrrolidinemethanol
- 2-Pyrrolidinemethanol, a,a-diphenyl-1-(phenylmethyl)-, (2S)-
- (S)-(+)-1-benzyl-2-(1-hydroxy-1,1-diphenylmethyl)-pyrrolidine
- (S)-1-benzyl-2-(hydroxydiphenylmethyl)pyrrolidine
- [(2S)-1-benzylpyrrolidin-2-yl]diphenylmethanol
- AC1LOBO4
- AK119833
- KB-210520
- N-benzyl-(S)-diphenyl(pyrrolidin-2-yl)methanol
- (2S)-(S)-(1-Benzylpyrrolidin-2-yl)diphenylmethanol
- (S)- (2S)-α,α-Diphenyl-1-(phenylmethyl)-2-pyrrolidinemethanol
- (2S)-alpha,alpha-Diphenyl-1-
(phenylmethyl)-2-pyrrolidinemethanol
- (R)-3-hydroxy-13-(phosphonooxy)-propanoic acid trisodium salt hydrate
- C24H25NO
- 3199AA
- AX8245249
- ST24035682
- Diphenyl(1-benzylpyrrolidine-2alpha-yl)methanol
- [(2S)-1-benzylpyrrolidin-2-yl]-diphenylmethanol
- SCHEMBL20128479
- AKOS016010916
- C71614
- 118970-95-9
- CS-0156293
- CHEMBL4908363
- MFCD18785744
- A892779
- DTXSID60361407
- DS-2829
- (2S)-α,α-Diphenyl-1-(phenylmethyl)-2-pyrrolidinemethanol
物化性质
实验特性
LogP |
4.52500 |
PSA |
23.47000 |
计算特性
精确分子量 |
343.19400 |
氢键供体数量 |
1 |
氢键受体数量 |
2 |
可旋转化学键数量 |
5 |
同位素质量 |
343.194 |
重原子数量 |
26 |
复杂度 |
400 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
1 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
4.6 |
拓扑分子极性表面积 |
23.5 |