2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide
2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide
Compound characteristics
Compound ID: | D285-0074 |
Compound Name: | 2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide |
Molecular Weight: | 454.51 |
Molecular Formula: | C25 H18 N4 O3 S |
Smiles: | C(C(Nc1ccc(cc1)Oc1ccccc1)=O)SC1NC(C(C#N)=C(c2ccccc2)N=1)=O |
Stereo: | ACHIRAL |
logP: | 4.4104 |
logD: | 0.8574 |
logSw: | -4.3945 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.336 |
InChI Key: | HOZYVOZTGCTYNM-UHFFFAOYSA-N |