4-methoxy-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]benzamide
Chemical Structure Depiction of
4-methoxy-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]benzamide
4-methoxy-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]benzamide
Compound characteristics
| Compound ID: | K284-4841 |
| Compound Name: | 4-methoxy-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]benzamide |
| Molecular Weight: | 462.48 |
| Molecular Formula: | C23 H18 N4 O5 S |
| Smiles: | COc1ccc(cc1)C(NN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8512 |
| logD: | 2.8497 |
| logSw: | -3.7274 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.098 |
| InChI Key: | LNHHUUBVHBPJRG-UHFFFAOYSA-N |