N-{6-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-methylbenzamide
Chemical Structure Depiction of
N-{6-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-methylbenzamide
N-{6-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-methylbenzamide
Compound characteristics
| Compound ID: | V013-3535 |
| Compound Name: | N-{6-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl}-3-methylbenzamide |
| Molecular Weight: | 485 |
| Molecular Formula: | C24 H25 Cl N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(nc1)N1CCCN(CC1)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1333 |
| logD: | 5.1322 |
| logSw: | -5.5831 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.233 |
| InChI Key: | XKPYIZHIWKGKJS-UHFFFAOYSA-N |