N-[(2-chlorophenyl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
N-[(2-chlorophenyl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F937-0481 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide |
| Molecular Weight: | 303.79 |
| Molecular Formula: | C16 H18 Cl N3 O |
| Smiles: | CC(C)c1ncc(C(NCc2ccccc2[Cl])=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5178 |
| logD: | 3.5173 |
| logSw: | -3.6893 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.321 |
| InChI Key: | REXGVPORIRKJSJ-UHFFFAOYSA-N |