2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | D285-0006 |
Compound Name: | 2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide |
Molecular Weight: | 286.31 |
Molecular Formula: | C13 H10 N4 O2 S |
Smiles: | C(C(N)=O)SC1NC(C(C#N)=C(c2ccccc2)N=1)=O |
Stereo: | ACHIRAL |
logP: | 0.5593 |
logD: | -2.9937 |
logSw: | -2.1011 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.098 |
InChI Key: | DEWSOYQTAXPNOB-UHFFFAOYSA-N |