3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-8730 |
| Compound Name: | 3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 381.41 |
| Molecular Formula: | C20 H20 F N5 O2 |
| Smiles: | C(CN1C(c2ccccc2N=N1)=O)C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3796 |
| logD: | 2.3796 |
| logSw: | -2.7335 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.263 |
| InChI Key: | MNQAGUYDWATWHP-UHFFFAOYSA-N |