N-[1-(adamantan-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-[1-(adamantan-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E008-0195 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 474.67 |
| Molecular Formula: | C28 H34 N4 O S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2419 |
| logD: | 6.2419 |
| logSw: | -5.4968 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.491 |
| InChI Key: | SULMZMPUMWXDNA-IFDVCUOJSA-N |