2-(3-chloro-4-methylanilino)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chloro-4-methylanilino)-6-methylpyrimidin-4(3H)-one
2-(3-chloro-4-methylanilino)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D416-0342 |
| Compound Name: | 2-(3-chloro-4-methylanilino)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 249.7 |
| Molecular Formula: | C12 H12 Cl N3 O |
| Smiles: | CC1=CC(NC(Nc2ccc(C)c(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0445 |
| logD: | 2.8039 |
| logSw: | -3.5128 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.356 |
| InChI Key: | NCECTAHOPXYCNH-UHFFFAOYSA-N |