2-anilino-5-bromo-6-propylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-anilino-5-bromo-6-propylpyrimidin-4(3H)-one
2-anilino-5-bromo-6-propylpyrimidin-4(3H)-one
Compound characteristics
Compound ID: | D416-0001 |
Compound Name: | 2-anilino-5-bromo-6-propylpyrimidin-4(3H)-one |
Molecular Weight: | 308.18 |
Molecular Formula: | C13 H14 Br N3 O |
Smiles: | CCCC1=C(C(NC(Nc2ccccc2)=N1)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 3.0455 |
logD: | 2.7982 |
logSw: | -3.357 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 44.816 |
InChI Key: | XRJKLQYJFUVDKW-UHFFFAOYSA-N |