4-({[3-(4-fluorophenyl)-6,7,8-trimethoxy-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
4-({[3-(4-fluorophenyl)-6,7,8-trimethoxy-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile
4-({[3-(4-fluorophenyl)-6,7,8-trimethoxy-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V019-8750 |
| Compound Name: | 4-({[3-(4-fluorophenyl)-6,7,8-trimethoxy-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 477.51 |
| Molecular Formula: | C25 H20 F N3 O4 S |
| Smiles: | COc1cc2C(N(C(=Nc2c(c1OC)OC)SCc1ccc(C#N)cc1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0629 |
| logD: | 4.0627 |
| logSw: | -4.3012 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.028 |
| InChI Key: | FQCZIFUNAHACHP-UHFFFAOYSA-N |