6,7,8-trimethoxy-3-(4-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
6,7,8-trimethoxy-3-(4-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
6,7,8-trimethoxy-3-(4-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V020-1848 |
| Compound Name: | 6,7,8-trimethoxy-3-(4-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 509.54 |
| Molecular Formula: | C25 H23 N3 O7 S |
| Smiles: | COc1ccc(cc1)N1C(=Nc2c(cc(c(c2OC)OC)OC)C1=O)SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2874 |
| logD: | 4.2873 |
| logSw: | -4.4998 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.897 |
| InChI Key: | TZFUCSIBXRGXLK-UHFFFAOYSA-N |