N-[2-(4-chlorophenyl)pyrimidin-5-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)pyrimidin-5-yl]-3-methylbutanamide
N-[2-(4-chlorophenyl)pyrimidin-5-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | P212-1123 |
| Compound Name: | N-[2-(4-chlorophenyl)pyrimidin-5-yl]-3-methylbutanamide |
| Molecular Weight: | 289.76 |
| Molecular Formula: | C15 H16 Cl N3 O |
| Smiles: | CC(C)CC(Nc1cnc(c2ccc(cc2)[Cl])nc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9371 |
| logD: | 3.937 |
| logSw: | -4.3345 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.731 |
| InChI Key: | XCTZPMUJYLDOPX-UHFFFAOYSA-N |