3-[(furan-2-yl)methyl]-6,7-dimethoxy-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[(furan-2-yl)methyl]-6,7-dimethoxy-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[(furan-2-yl)methyl]-6,7-dimethoxy-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-5459 |
| Compound Name: | 3-[(furan-2-yl)methyl]-6,7-dimethoxy-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 453.47 |
| Molecular Formula: | C22 H19 N3 O6 S |
| Smiles: | COc1cc2C(N(Cc3ccco3)C(=Nc2cc1OC)SCc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1383 |
| logD: | 4.1383 |
| logSw: | -4.3662 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.162 |
| InChI Key: | GHNREJHQTDWZRC-UHFFFAOYSA-N |