4-methoxy-N-[4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}quinazolin-3(4H)-yl]benzamide
Chemical Structure Depiction of
4-methoxy-N-[4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}quinazolin-3(4H)-yl]benzamide
4-methoxy-N-[4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}quinazolin-3(4H)-yl]benzamide
Compound characteristics
| Compound ID: | K284-4834 |
| Compound Name: | 4-methoxy-N-[4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}quinazolin-3(4H)-yl]benzamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | COc1ccc(cc1)C(NN1C(=Nc2ccccc2C1=O)SCC(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6449 |
| logD: | 1.6427 |
| logSw: | -2.5435 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.475 |
| InChI Key: | RMZOQAHWFSRKHL-UHFFFAOYSA-N |