1-[4-(2-fluorophenyl)piperazin-1-yl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | D692-0582 |
| Compound Name: | 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 488.54 |
| Molecular Formula: | C25 H21 F N6 O2 S |
| Smiles: | C1CN(CCN1C(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.8864 |
| logD: | 3.8863 |
| logSw: | -4.0956 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.24 |
| InChI Key: | BELADIQNRLGQAH-UHFFFAOYSA-N |