N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | F882-0179 |
| Compound Name: | N-(2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 504.92 |
| Molecular Formula: | C23 H16 Cl F3 N4 O2 S |
| Smiles: | C(C1=CC(N2C=C(C=CC2=N1)[Cl])=O)Sc1ccccc1NC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8906 |
| logD: | 4.8906 |
| logSw: | -5.1418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.077 |
| InChI Key: | UCRXNANKSFBUJU-UHFFFAOYSA-N |