4-chloro-N-{2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-3-nitro-N-propylbenzamide
Chemical Structure Depiction of
4-chloro-N-{2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-3-nitro-N-propylbenzamide
4-chloro-N-{2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-3-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V010-3177 |
| Compound Name: | 4-chloro-N-{2-[4-(4-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-3-nitro-N-propylbenzamide |
| Molecular Weight: | 532.44 |
| Molecular Formula: | C25 H23 Cl2 N3 O4 S |
| Smiles: | CCCN(CC(N1CCc2c(ccs2)C1c1ccc(cc1)[Cl])=O)C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5258 |
| logD: | 5.5258 |
| logSw: | -6.1037 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.894 |
| InChI Key: | YOPYRKNXDJMKGG-XMMPIXPASA-N |