N-[2-(azepan-1-yl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C857-2239 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 430.61 |
| Molecular Formula: | C22 H34 N6 O S |
| Smiles: | Cc1ccc(C)n1c1nnc(N2CCCC(C2)C(NCCN2CCCCCC2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9469 |
| logD: | 1.1642 |
| logSw: | -3.0442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.215 |
| InChI Key: | HDPWMJZWSFFTFM-IBGZPJMESA-N |