4-chloro-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
4-chloro-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | F880-0693 |
| Compound Name: | 4-chloro-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 421.9 |
| Molecular Formula: | C22 H16 Cl N3 O2 S |
| Smiles: | C(C1=CC(N2C=CC=CC2=N1)=O)Sc1ccccc1NC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7937 |
| logD: | 3.7926 |
| logSw: | -4.5903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.347 |
| InChI Key: | CIYVGTIMKKFSLL-UHFFFAOYSA-N |