1-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
1-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one
Compound characteristics
| Compound ID: | V002-9004 |
| Compound Name: | 1-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-[4-(2-methylphenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]propan-1-one |
| Molecular Weight: | 523.72 |
| Molecular Formula: | C28 H33 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CC(C(N1CCCN(CC1)S(c1ccccc1)(=O)=O)=O)N1CCc2c(ccs2)C1c1ccccc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.865 |
| logD: | 4.837 |
| logSw: | -4.4928 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.406 |
| InChI Key: | IFHWSOGJJCARTE-UHFFFAOYSA-N |