N-(3-chloro-4-fluorophenyl)-4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(3-chloro-4-fluorophenyl)-4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D574-0045 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C20 H24 Cl F N6 O |
| Smiles: | Cc1cc(nc(n1)N1CCCC1)N1CCN(CC1)C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6305 |
| logD: | 4.6182 |
| logSw: | -4.7947 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.554 |
| InChI Key: | CJDHTEPDHLMZAP-UHFFFAOYSA-N |