2-(4-chlorophenyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-6-methylpyrimidin-4(3H)-one
2-(4-chlorophenyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | S553-0058 |
| Compound Name: | 2-(4-chlorophenyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 220.66 |
| Molecular Formula: | C11 H9 Cl N2 O |
| Smiles: | CC1=CC(NC(c2ccc(cc2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1046 |
| logD: | 0.2314 |
| logSw: | -3.1966 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.69 |
| InChI Key: | BJQUXXXXEUWVJX-UHFFFAOYSA-N |