Ethyl 3-(tert-butyl)-1-(3-nitro-2-pyridinyl)-1H-pyrazole-5-carboxylate
CAS N/A MFCD05021846
化学结构图
SMILES: CCOC(=O)C1=CC(=NN1C1=NC=CC=C1[N+]([O-])=O)C(C)(C)C
化学属性
| Mol. Formula | C15H18N4O4 |
|---|---|
| Mol. Weight | 318.34 |
| Melting Point | 99-101° |
别名和识别编码
| Chemical Name | Ethyl 3-(tert-butyl)-1-(3-nitro-2-pyridinyl)-1H-pyrazole-5-carboxylate |
|---|---|
| Alfabeta Name | ETHYLBUTYLNITROPYRIDINYLPYRAZOLECARBOXYLATE TERTH313215(())----------- |
| MDL Number | MFCD05021846 |
分类
- {KO} Nitros
- {KO} Esters
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
6
Rotatable Bonds
5
H-bond Donors
0
LogP
3
