4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(2-methylpropyl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(2-methylpropyl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(2-methylpropyl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V004-9681 |
| Compound Name: | 4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(2-methylpropyl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C24 H33 Cl F N5 O |
| Smiles: | CCc1c(Cc2c(cccc2[Cl])F)c(nc(CC(C)C)n1)N1CCN(CC1)C(NCC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7216 |
| logD: | 5.6482 |
| logSw: | -5.9434 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.676 |
| InChI Key: | YGRTVSLWVKDZIS-UHFFFAOYSA-N |