4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}-N-(propan-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}-N-(propan-2-yl)piperazine-1-carboxamide
4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}-N-(propan-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V017-6591 |
| Compound Name: | 4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}-N-(propan-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 401.94 |
| Molecular Formula: | C21 H28 Cl N5 O |
| Smiles: | CC(C)NC(N1CCN(CC1)c1c(Cc2ccc(cc2)[Cl])c(C)nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2672 |
| logD: | 4.1783 |
| logSw: | -4.5077 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.958 |
| InChI Key: | FVGCTKKOFQURCP-UHFFFAOYSA-N |