N-(3,5-dimethylphenyl)-N'-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-N'-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
N-(3,5-dimethylphenyl)-N'-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
Compound characteristics
Compound ID: | F882-0391 |
Compound Name: | N-(3,5-dimethylphenyl)-N'-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea |
Molecular Weight: | 430.53 |
Molecular Formula: | C24 H22 N4 O2 S |
Smiles: | Cc1cc(C)cc(c1)NC(Nc1ccccc1SCC1=CC(N2C=CC=CC2=N1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3452 |
logD: | 4.3452 |
logSw: | -4.3338 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.558 |
InChI Key: | YVOISPQTNKQVFT-UHFFFAOYSA-N |