N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F864-0298 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-3-carboxamide |
| Molecular Weight: | 498.65 |
| Molecular Formula: | C25 H34 N6 O3 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(C(N2CCCC(C2)C(NCCN2CCCCCC2)=O)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7014 |
| logD: | 0.9188 |
| logSw: | -3.174 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.984 |
| InChI Key: | BRSCLYIWDXZPIO-IBGZPJMESA-N |