N-{4-[4-(butan-2-yl)phenyl]-3-cyano-5-methylthiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-{4-[4-(butan-2-yl)phenyl]-3-cyano-5-methylthiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
N-{4-[4-(butan-2-yl)phenyl]-3-cyano-5-methylthiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y207-3723 |
| Compound Name: | N-{4-[4-(butan-2-yl)phenyl]-3-cyano-5-methylthiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C21 H22 N4 O S |
| Smiles: | CCC(C)c1ccc(cc1)c1c(C#N)c(NC(c2ccnn2C)=O)sc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8921 |
| logD: | 4.5202 |
| logSw: | -4.5979 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.559 |
| InChI Key: | JJXNYXMBEHHMOS-ZDUSSCGKSA-N |