4-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-6,7-dimethoxyquinazoline-2(1H)-thione
Chemical Structure Depiction of
4-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-6,7-dimethoxyquinazoline-2(1H)-thione
4-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-6,7-dimethoxyquinazoline-2(1H)-thione
Compound characteristics
| Compound ID: | C431-0054 |
| Compound Name: | 4-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-6,7-dimethoxyquinazoline-2(1H)-thione |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C23 H28 F N5 O2 S |
| Smiles: | COc1cc2C(NCCCN3CCN(CC3)c3ccccc3F)=NC(Nc2cc1OC)=S |
| Stereo: | ACHIRAL |
| logP: | 2.798 |
| logD: | 0.5212 |
| logSw: | -3.5152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.106 |
| InChI Key: | SWLMPGVLIGONLR-UHFFFAOYSA-N |