1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one
Compound characteristics
| Compound ID: | V002-7942 |
| Compound Name: | 1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-3-(4-phenyl-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)propan-1-one |
| Molecular Weight: | 542.53 |
| Molecular Formula: | C28 H29 Cl2 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(c1ccc(cc1[Cl])[Cl])=O)C(CCN1CCc2c(ccs2)C1c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3852 |
| logD: | 4.8075 |
| logSw: | -5.9815 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.175 |
| InChI Key: | CXPDIMBNZQKTGR-UHFFFAOYSA-N |