N-{6-[4-(4-chloro-2-fluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{6-[4-(4-chloro-2-fluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-4-methylbenzamide
N-{6-[4-(4-chloro-2-fluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V013-2417 |
| Compound Name: | N-{6-[4-(4-chloro-2-fluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-4-methylbenzamide |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C24 H22 Cl F N4 O2 |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1ccc(cc1F)[Cl])=O)c1ccc(cn1)NC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.257 |
| logD: | 5.2564 |
| logSw: | -5.6493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.839 |
| InChI Key: | BSUJRYGRANHIRE-UHFFFAOYSA-N |