2-(4-chloro-2-methylanilino)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-chloro-2-methylanilino)-6-methylpyrimidin-4(3H)-one
2-(4-chloro-2-methylanilino)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D416-0392 |
| Compound Name: | 2-(4-chloro-2-methylanilino)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 249.7 |
| Molecular Formula: | C12 H12 Cl N3 O |
| Smiles: | CC1=CC(NC(Nc2ccc(cc2C)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7499 |
| logD: | 2.6381 |
| logSw: | -3.448 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.659 |
| InChI Key: | MQAUNNDYVXAKDZ-UHFFFAOYSA-N |