2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V019-8828 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-6,7,8-trimethoxyquinazolin-4(3H)-one |
| Molecular Weight: | 486.95 |
| Molecular Formula: | C24 H20 Cl F N2 O4 S |
| Smiles: | COc1cc2C(N(C(=Nc2c(c1OC)OC)SCc1ccc(cc1)[Cl])c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0032 |
| logD: | 5.003 |
| logSw: | -5.079 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.972 |
| InChI Key: | XWXWIEVCSQFHLJ-UHFFFAOYSA-N |