1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Compound characteristics
| Compound ID: | V006-1861 |
| Compound Name: | 1-[4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one |
| Molecular Weight: | 544.13 |
| Molecular Formula: | C27 H30 Cl N3 O3 S2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)S(c1ccc(cc1)[Cl])(=O)=O)C(CCN1CCc2c(ccs2)C1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7542 |
| logD: | 4.1765 |
| logSw: | -5.0809 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.35 |
| InChI Key: | GBGFMSOPROSQRR-HHHXNRCGSA-N |