CAS 390-64-7|Prenilamina [inn-spanish]|Prenylaminum [inn-latin]|Valecor|Segontin|difril|DL-prenylamine|Hostaginan|Synadrin|1-Phenyl-2-(1',1'-diphenylpropyl-3'-amino)propane|Falliocor|Prenylamine|Bis...

基本信息

化学结构

分子式

C₂₄H₂₇N

分子量

329.47788

精确质量

329.21434987

电荷

InChI

InChI=1S/C24H27N/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,20,24-25H,17-19H2,1H3

InChIKey

IFFPICMESYHZPQ-UHFFFAOYSA-N

Canonic Smiles

CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1

Isomeric Smiles

N(CCC(c1ccccc1)c1ccccc1)C(Cc1ccccc1)C

计算属性

JChem

质子受体

质子供体

LogD (pH = 5.5)

2.8811786

LogD (pH = 7.4)

3.261855

Log P

6.115357

摩尔折射率

107.092

极化性

42.115356

极化表面积

12.03

可自由旋转的化学键

里宾斯基五规则

false

ALOGPS 2.1

Log P

5.89

LOG S

-6.97

溶解度

3.54e-05 g/l

数据来源

学术数据

产品目录

数据来源

名称和标识

别名

PrenylaminePrenilamina [inn-spanish]N-(1-Methyl-2-phenylethyl)-3,3-diphenyl-1-propanamineN-(3,3-Diphenylpropyl)-alpha-methylphenethylamine1-Phenyl-2-(1',1'-diphenylpropyl-3'-amino)propaneN-(1-Methyl-2-phenylethyl)-gamma-phenylbenzenepropanamineN-(3,3-Diphenylpropyl)-alpha-methylphenaethylamin [German]DL-prenylaminePrenylaminum [inn-latin]N-(3'-Phenyl-2-propyl)-1,1-diphenyl-3-propyloamineSandoz 13-194N-(3,3-Diphenylpropyl)-α-methylphenethylamineSAN 13-194N-(1-Methyl-2-phenylethyl)-γ-phenylbenzenepropanamineElecorSegontin

IUPAC传统名

difril prenylamine

商标名

CarditinFalliocorCorontinValecorSynadrinHostaginanBismethinSegontinElecorCorpax

IUPAC标准名

(3,3-diphenylpropyl)(1-phenylpropan-2-yl)amine

名称和标识

数据登录号

CAS号

390-64-7

PubChem CID

9801