3-(4-fluorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-(4-fluorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K289-0499 |
| Compound Name: | 3-(4-fluorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 550.63 |
| Molecular Formula: | C29 H28 F2 N4 O3 S |
| Smiles: | C(CNC(c1ccc2C(N(C(=Nc2c1)SCc1cccc(c1)F)c1ccc(cc1)F)=O)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.341 |
| logD: | 2.9528 |
| logSw: | -3.7188 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.305 |
| InChI Key: | JHVLKGRLMCPIRO-UHFFFAOYSA-N |