5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F864-0679 |
| Compound Name: | 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 476 |
| Molecular Formula: | C22 H26 Cl N5 O3 S |
| Smiles: | C1CCCN(CC1)C(C1CCCN(C1)C(c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3126 |
| logD: | 3.2682 |
| logSw: | -3.762 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.395 |
| InChI Key: | MRJBFOBTNFZSAX-HNNXBMFYSA-N |