methyl [4-oxo-2-{[(pyridin-2-yl)methyl]sulfanyl}quinazolin-3(4H)-yl]acetate
Chemical Structure Depiction of
methyl [4-oxo-2-{[(pyridin-2-yl)methyl]sulfanyl}quinazolin-3(4H)-yl]acetate
methyl [4-oxo-2-{[(pyridin-2-yl)methyl]sulfanyl}quinazolin-3(4H)-yl]acetate
Compound characteristics
| Compound ID: | Y501-4907 |
| Compound Name: | methyl [4-oxo-2-{[(pyridin-2-yl)methyl]sulfanyl}quinazolin-3(4H)-yl]acetate |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | COC(CN1C(=Nc2ccccc2C1=O)SCc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5913 |
| logD: | 1.5911 |
| logSw: | -2.4296 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.165 |
| InChI Key: | VITAIKCTJYRRQX-UHFFFAOYSA-N |