N-(2-chlorophenyl)-4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(2-chlorophenyl)-4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D430-2291 |
| Compound Name: | N-(2-chlorophenyl)-4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 429.95 |
| Molecular Formula: | C21 H28 Cl N7 O |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)C(Nc1ccccc1[Cl])=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.4312 |
| logD: | 2.8613 |
| logSw: | -3.6314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.31 |
| InChI Key: | YKCSSMPWLNKUQT-UHFFFAOYSA-N |