1-[4-Nitro-2-(trifluoromethyl)phenyl]-3-piperidinecarboxylic acid
CAS N/A MFCD11039558
化学结构图
SMILES: [O-][N+](=O)C1C=C(C(=CC=1)N1CC(CCC1)C(O)=O)C(F)(F)F
化学属性
| Mol. Formula | C13H13F3N2O4 |
|---|---|
| Mol. Weight | 318.25 |
| Melting Point | 147-149° |
别名和识别编码
| Chemical Name | 1-[4-Nitro-2-(trifluoromethyl)phenyl]-3-piperidinecarboxylic acid |
|---|---|
| Alfabeta Name | NITROTRIFLUOROMETHYLPHENYLPIPERIDINECARBOXYLICACID 1423[]()------ |
| MDL Number | MFCD11039558 |
分类
- {KO} Nitros
- {KO} CarboxylicAcids
安全信息
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
2
H-bond Donors
1
LogP
2
