3-(2,5-dichlorophenyl)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6,7,8-trimethoxyquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(2,5-dichlorophenyl)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6,7,8-trimethoxyquinazolin-4(3H)-one
3-(2,5-dichlorophenyl)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6,7,8-trimethoxyquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V008-8935 |
| Compound Name: | 3-(2,5-dichlorophenyl)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6,7,8-trimethoxyquinazolin-4(3H)-one |
| Molecular Weight: | 539.38 |
| Molecular Formula: | C24 H18 Cl2 F2 N2 O4 S |
| Smiles: | COc1cc2C(N(C(=Nc2c(c1OC)OC)SCc1ccc(c(c1)F)F)c1cc(ccc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0076 |
| logD: | 6.0075 |
| logSw: | -6.0952 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.671 |
| InChI Key: | LMDRCXIFMLFBKA-UHFFFAOYSA-N |