N-(3-fluoro-4-methylphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(3-fluoro-4-methylphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D639-0019 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H27 F N6 O |
| Smiles: | Cc1ccc(cc1F)NC(N1CCN(CC1)c1cc(nc(C)n1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3808 |
| logD: | 4.3572 |
| logSw: | -4.2786 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.897 |
| InChI Key: | JPIHYABHADJMPH-UHFFFAOYSA-N |