N-[1-(adamantan-1-yl)ethyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
N-[1-(adamantan-1-yl)ethyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8009-9504 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 499.6 |
| Molecular Formula: | C27 H28 F3 N3 O S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CSc1c(C#N)c(cc(c2ccccc2)n1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8852 |
| logD: | 6.8852 |
| logSw: | -5.774 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.167 |
| InChI Key: | AOSQKJFJGWPJHN-BTVKBFDZSA-N |