2-(3-chloro-4-methoxyanilino)-6-ethylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chloro-4-methoxyanilino)-6-ethylpyrimidin-4(3H)-one
2-(3-chloro-4-methoxyanilino)-6-ethylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D416-0216 |
| Compound Name: | 2-(3-chloro-4-methoxyanilino)-6-ethylpyrimidin-4(3H)-one |
| Molecular Weight: | 279.72 |
| Molecular Formula: | C13 H14 Cl N3 O2 |
| Smiles: | CCC1=CC(NC(Nc2ccc(c(c2)[Cl])OC)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6989 |
| logD: | 2.4671 |
| logSw: | -3.4909 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.594 |
| InChI Key: | LTNCOPVUVOQJRE-UHFFFAOYSA-N |