N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-(2,5-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-(2,5-dimethoxyphenyl)urea
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-(2,5-dimethoxyphenyl)urea
Compound characteristics
| Compound ID: | F882-0160 |
| Compound Name: | N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-(2,5-dimethoxyphenyl)urea |
| Molecular Weight: | 496.97 |
| Molecular Formula: | C24 H21 Cl N4 O4 S |
| Smiles: | COc1ccc(c(c1)NC(Nc1ccccc1SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5317 |
| logD: | 3.5317 |
| logSw: | -4.0555 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.554 |
| InChI Key: | NGUZNZHCNDUPIK-UHFFFAOYSA-N |