N-(3,4-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazine-1-carboxamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazine-1-carboxamide
N-(3,4-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V009-8758 |
| Compound Name: | N-(3,4-dichlorophenyl)-4-{[4-(3-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]acetyl}-2-methylpiperazine-1-carboxamide |
| Molecular Weight: | 561.51 |
| Molecular Formula: | C27 H27 Cl2 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(Nc1ccc(c(c1)[Cl])[Cl])=O)C(CN1CCc2c(ccs2)C1c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8638 |
| logD: | 5.8411 |
| logSw: | -6.1022 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.017 |
| InChI Key: | BECWFXCELFQDSZ-UHFFFAOYSA-N |