5-(Chloromethyl)-1-phenyl-1H-1,2,4-triazole-3-carboxylic acid
CAS N/A MFCD16090020
化学结构图
SMILES: OC(=O)C1N=C(CCl)N(N=1)C1C=CC=CC=1
化学属性
| Mol. Weight | 237.65 |
|---|---|
| Mol. Formula | C10H8ClN3O2 |
别名和识别编码
| Chemical Name | 5-(Chloromethyl)-1-phenyl-1H-1,2,4-triazole-3-carboxylic acid |
|---|---|
| Alfabeta Name | CHLOROMETHYLPHENYLTRIAZOLECARBOXYLICACID H5111243()--------,, |
| MDL Number | MFCD16090020 |
分类
- {KO} ReacChlorides
- {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
3
H-bond Donors
1
LogP
2
