3-Nitro-4-{[3-(trifluoromethyl)benzyl]-sulfanyl}benzenecarbaldehyde
CAS N/A MFCD07698578
化学结构图
SMILES: [O-][N+](=O)C1C=C(C=CC=1SCC1C=C(C=CC=1)C(F)(F)F)C=O
化学属性
| Mol. Formula | C15H10F3NO3S |
|---|---|
| Mol. Weight | 341.31 |
| Melting Point | 142-144° |
别名和识别编码
| Chemical Name | 3-Nitro-4-{[3-(trifluoromethyl)benzyl]-sulfanyl}benzenecarbaldehyde |
|---|---|
| Alfabeta Name | NITROTRIFLUOROMETHYLBENZYLSULFANYLBENZENECARBALDEHYDE 343[]()-----{} |
| MDL Number | MFCD07698578 |
分类
- {KO} Nitros
- {KO} Aldehydes
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
3
Rotatable Bonds
4
H-bond Donors
0
LogP
4
