N-(1-phenylbutan-2-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(1-phenylbutan-2-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-(1-phenylbutan-2-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E008-0202 |
| Compound Name: | N-(1-phenylbutan-2-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C26 H28 N4 O S |
| Smiles: | CCC(Cc1ccccc1)NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1575 |
| logD: | 6.1575 |
| logSw: | -5.4026 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.203 |
| InChI Key: | ICFHHEPOOAAFKB-QHCPKHFHSA-N |