2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
Compound ID: | D285-0256 |
Compound Name: | 2-{[5-cyano-4-(4-methylphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
Molecular Weight: | 418.52 |
Molecular Formula: | C23 H22 N4 O2 S |
Smiles: | CC(C)c1ccc(cc1)NC(CSC1NC(C(C#N)=C(c2ccc(C)cc2)N=1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.587 |
logD: | 1.034 |
logSw: | -4.2587 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.588 |
InChI Key: | RTSYYNOLUJNDCN-UHFFFAOYSA-N |