1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Chemical Structure Depiction of
1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Compound characteristics
| Compound ID: | C684-0099 |
| Compound Name: | 1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one |
| Molecular Weight: | 534.6 |
| Molecular Formula: | C30 H27 F N8 O |
| Smiles: | C(CC(N1CCN(CC1)c1ccc(cc1)F)=O)Cc1nnc2n1c1ccccc1c1nc(c3ccccc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 3.9937 |
| logD: | 3.5809 |
| logSw: | -4.2483 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.022 |
| InChI Key: | IOTJDFMWIOBAMB-UHFFFAOYSA-N |