3-chloro-4-fluoro-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3-chloro-4-fluoro-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
3-chloro-4-fluoro-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
Compound ID: | F880-0602 |
Compound Name: | 3-chloro-4-fluoro-N-(2-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzamide |
Molecular Weight: | 453.92 |
Molecular Formula: | C23 H17 Cl F N3 O2 S |
Smiles: | CC1C=CN2C(C=1)=NC(CSc1ccccc1NC(c1ccc(c(c1)[Cl])F)=O)=CC2=O |
Stereo: | ACHIRAL |
logP: | 4.0513 |
logD: | 4.0423 |
logSw: | -4.4281 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.347 |
InChI Key: | VXFOUVHUMLDTRT-UHFFFAOYSA-N |