2-(3,4-dichloroanilino)-6-propylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3,4-dichloroanilino)-6-propylpyrimidin-4(3H)-one
2-(3,4-dichloroanilino)-6-propylpyrimidin-4(3H)-one
Compound characteristics
Compound ID: | D083-0026 |
Compound Name: | 2-(3,4-dichloroanilino)-6-propylpyrimidin-4(3H)-one |
Molecular Weight: | 298.17 |
Molecular Formula: | C13 H13 Cl2 N3 O |
Smiles: | CCCC1=CC(NC(Nc2ccc(c(c2)[Cl])[Cl])=N1)=O |
Stereo: | ACHIRAL |
logP: | 4.1901 |
logD: | 3.9122 |
logSw: | -4.3711 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 44.963 |
InChI Key: | PLGBHHLEGBEVQY-UHFFFAOYSA-N |