4-{2-[4-(Trifluoromethyl)piperidino]acetyl}-1H-pyrrole-2-carbaldehyde
CAS N/A MFCD09864685
化学结构图
SMILES: O=C(CN1CCC(CC1)C(F)(F)F)C1C=C(C=O)NC=1
化学属性
| Mol. Formula | C13H15F3N2O2 |
|---|---|
| Mol. Weight | 288.27 |
| Melting Point | 142-144° |
别名和识别编码
| Chemical Name | 4-{2-[4-(Trifluoromethyl)piperidino]acetyl}-1H-pyrrole-2-carbaldehyde |
|---|---|
| Alfabeta Name | TRIFLUOROMETHYLPIPERIDINOACETYLPYRROLECARBALDEHYDE H42412[]()-------{} |
| MDL Number | MFCD09864685 |
分类
- {KO} Aldehydes
- {KO} Ketones
- {KO} AminesSecondaryHeteroNH
安全信息
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
3
Rotatable Bonds
4
LogP
1
