3-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
3-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | K279-0772 |
| Compound Name: | 3-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide |
| Molecular Weight: | 601.08 |
| Molecular Formula: | C30 H25 Cl N6 O4 S |
| Smiles: | COc1ccc(CNC(CCC2C(N=C3c4ccccc4N=C(N23)SCC2=CC(N3C=C(C=CC3=N2)[Cl])=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3422 |
| logD: | 2.3415 |
| logSw: | -3.4369 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.672 |
| InChI Key: | CBUPYZSZUMVTBT-DEOSSOPVSA-N |