2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F365-0059 |
| Compound Name: | 2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C25 H27 F N6 O3 |
| Smiles: | CC(C)CN1C2=NN(CC(N3CCN(CC3)c3ccc(cc3)F)=O)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9825 |
| logD: | 2.9825 |
| logSw: | -3.5939 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.86 |
| InChI Key: | OIWWXNNBTZCOHC-UHFFFAOYSA-N |