7-chloro-2-{[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-chloro-2-{[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
7-chloro-2-{[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | C445-0078 |
| Compound Name: | 7-chloro-2-{[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 530.99 |
| Molecular Formula: | C26 H19 Cl N6 O3 S |
| Smiles: | COc1cc2c(cc1OC)nc(n1c2nc(c2ccccc2)n1)SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.011 |
| logD: | 4.0046 |
| logSw: | -4.5463 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.563 |
| InChI Key: | RZXAHQTVBBGFOS-UHFFFAOYSA-N |