N-(3-chloro-4-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(3-chloro-4-methoxyphenyl)-4-[2-methyl-6-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D639-0025 |
| Compound Name: | N-(3-chloro-4-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(Nc1ccc(c(c1)[Cl])OC)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2417 |
| logD: | 4.218 |
| logSw: | -4.5133 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.528 |
| InChI Key: | SXYMESOFALGFPT-UHFFFAOYSA-N |