1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V025-6378 |
| Compound Name: | 1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 564.55 |
| Molecular Formula: | C26 H27 Cl2 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)S(c1ccc(cc1)[Cl])(=O)=O)C(CN1CCc2c(ccs2)C1c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1515 |
| logD: | 5.1399 |
| logSw: | -5.88 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.372 |
| InChI Key: | JZVQJHZLNDGXBZ-AREMUKBSSA-N |