N-(4-ethylphenyl)-N'-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(4-ethylphenyl)-N'-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
N-(4-ethylphenyl)-N'-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | F882-0338 |
| Compound Name: | N-(4-ethylphenyl)-N'-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)urea |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H24 N4 O2 S |
| Smiles: | CCc1ccc(cc1)NC(Nc1ccccc1SCC1=CC(N2C=CC=C(C)C2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9471 |
| logD: | 4.9471 |
| logSw: | -4.5577 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.579 |
| InChI Key: | VAZOFLXRJOZQDG-UHFFFAOYSA-N |