3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)quinazolin-4(3H)-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0681 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({[4-(trifluoromethoxy)phenyl]methyl}sulfanyl)quinazolin-4(3H)-one |
| Molecular Weight: | 516.54 |
| Molecular Formula: | C26 H23 F3 N2 O4 S |
| Smiles: | COc1ccc(CCN2C(=Nc3ccccc3C2=O)SCc2ccc(cc2)OC(F)(F)F)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.2974 |
| logD: | 5.2974 |
| logSw: | -5.2584 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.947 |
| InChI Key: | QRIDXDCYLWYNTQ-UHFFFAOYSA-N |