N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F863-0298 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}piperidine-4-carboxamide |
| Molecular Weight: | 498.65 |
| Molecular Formula: | C25 H34 N6 O3 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(C(N2CCC(CC2)C(NCCN2CCCCCC2)=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6113 |
| logD: | 0.8287 |
| logSw: | -3.064 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.05 |
| InChI Key: | MADMJMUYRHOZQH-UHFFFAOYSA-N |