2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V003-2256 |
| Compound Name: | 2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one |
| Molecular Weight: | 480.56 |
| Molecular Formula: | C26 H25 F N2 O4 S |
| Smiles: | Cc1ccc(CSC2=Nc3c(cc(c(c3OC)OC)OC)C(N2c2cccc(c2)F)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 5.7103 |
| logD: | 5.7102 |
| logSw: | -5.488 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.972 |
| InChI Key: | KYLGSLWBOWJRPZ-UHFFFAOYSA-N |