N-(5-chloro-2-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(5-chloro-2-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D639-0017 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 430.94 |
| Molecular Formula: | C21 H27 Cl N6 O2 |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)C(Nc1cc(ccc1OC)[Cl])=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.38 |
| logD: | 4.3561 |
| logSw: | -4.525 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.83 |
| InChI Key: | JHUMHNAWEUDUNG-UHFFFAOYSA-N |