tert-Butyl 5-cyano-3-formyl-6-(trifluoromethyl)-1H-indole-1-carboxylate
CAS N/A MFCD20921578
化学结构图
SMILES: CC(C)(C)OC(=O)N1C=C(C=O)C2=CC(C#N)=C(C=C12)C(F)(F)F
化学属性
| Mol. Weight | 338.29 |
|---|---|
| Melting Point | 303-304° |
| Mol. Formula | C16H13F3N2O3 |
别名和识别编码
| Chemical Name | tert-Butyl 5-cyano-3-formyl-6-(trifluoromethyl)-1H-indole-1-carboxylate |
|---|---|
| Alfabeta Name | BUTYLCYANOFORMYLTRIFLUOROMETHYLINDOLECARBOXYLATE TERTH53611()---------- |
| MDL Number | MFCD20921578 |
分类
- {KO} Nitriles
- {KO} Aldehydes
- {KO} tBocN
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
0
H-bond Acceptors
4
Rotatable Bonds
3
LogP
3
