N-benzyl-6-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-benzyl-6-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
N-benzyl-6-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | K250-0037 |
| Compound Name: | N-benzyl-6-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide |
| Molecular Weight: | 577.06 |
| Molecular Formula: | C31 H21 Cl N6 O2 S |
| Smiles: | C(c1ccccc1)NC(c1ccc2c(c1)nc(n1c3ccccc3nc12)SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1999 |
| logD: | 5.1995 |
| logSw: | -5.9029 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.737 |
| InChI Key: | NWMWVIWPOGUNTG-UHFFFAOYSA-N |