482-75-7 (((1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane)

CAS号:
482-75-7
英文名称:
(1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane
分子式:
C27H45N
分子量:
383.652908086777

(1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane(482-75-7)名称与标识符

名称

英文别名:
Cevane;(1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018;

标识符

InChIKey:
GRTNBDIOACKBEA-KZQQUQHJSA-N
Inchi:
1S/C27H45N/c1-17-7-12-26-18(2)20-10-11-21-22-9-8-19-6-4-5-13-27(19,3)25(22)14-23(21)24(20)16-28(26)15-17/h17-26H,4-16H2,1-3H3/t17-,18?,19-,20+,21-,22-,23+,24+,25-,26-,27-/m0/s1
SMILES:
N12C[C@@H](C)CC[C@H]1C(C)[C@H]1CC[C@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4C[C@H]3[C@@H]1C2

(1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane(482-75-7)物化性质

计算特性

  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 0
  • 重原子数量 : 28
  • 复杂度 : 599
  • 拓扑分子极性表面积 : 3.2

(1R,2S,6S,9S,11S,14S,15S,18S,23S,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane(482-75-7)相关文献