8-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
8-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
8-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F365-0377 |
| Compound Name: | 8-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 498.94 |
| Molecular Formula: | C24 H24 Cl F N6 O3 |
| Smiles: | CCCN1C2=NN(CC(N3CCN(CC3)c3ccc(cc3)F)=O)C(N2c2cc(ccc2C1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1383 |
| logD: | 3.1383 |
| logSw: | -3.4203 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.838 |
| InChI Key: | JTJKLPPQMOWQGP-UHFFFAOYSA-N |