3-(3,4-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-(3,4-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K289-0488 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 545.59 |
| Molecular Formula: | C29 H24 F N3 O5 S |
| Smiles: | COc1ccc(cc1OC)N1C(=Nc2cc(ccc2C1=O)C(NCc1ccco1)=O)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.5247 |
| logD: | 4.5246 |
| logSw: | -4.4065 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.582 |
| InChI Key: | KFWCKSYEUCFZMD-UHFFFAOYSA-N |