7-chloro-2-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinazolin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-chloro-2-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinazolin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
7-chloro-2-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinazolin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | K297-0491 |
| Compound Name: | 7-chloro-2-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinazolin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 534.04 |
| Molecular Formula: | C27 H24 Cl N5 O3 S |
| Smiles: | COc1ccc(CCNc2c3ccccc3nc(n2)SCC2=CC(N3C=C(C=CC3=N2)[Cl])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1637 |
| logD: | 4.1637 |
| logSw: | -4.5093 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.457 |
| InChI Key: | ABCWKMZISAMBBR-UHFFFAOYSA-N |