2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-6-(morpholin-4-yl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-6-(morpholin-4-yl)quinazolin-4(3H)-one
2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-6-(morpholin-4-yl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-6876 |
| Compound Name: | 2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(4-methoxyphenyl)methyl]-6-(morpholin-4-yl)quinazolin-4(3H)-one |
| Molecular Weight: | 576.07 |
| Molecular Formula: | C29 H26 Cl N5 O4 S |
| Smiles: | COc1ccc(CN2C(=Nc3ccc(cc3C2=O)N2CCOCC2)SCC2=CC(N3C=C(C=CC3=N2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2958 |
| logD: | 3.2958 |
| logSw: | -3.7723 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.181 |
| InChI Key: | GZQGLMTWGFMYTE-UHFFFAOYSA-N |