6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-6097 |
| Compound Name: | 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C25 H23 N3 O6 S |
| Smiles: | COc1ccc(CN2C(=Nc3cc(c(cc3C2=O)OC)OC)SCc2cccc(c2)[N+]([O-])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8672 |
| logD: | 4.8672 |
| logSw: | -4.6656 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.957 |
| InChI Key: | ZOVUYRINULPKRN-UHFFFAOYSA-N |