4-({2-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
Chemical Structure Depiction of
4-({2-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
4-({2-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate
Compound characteristics
| Compound ID: | 8005-7740 |
| Compound Name: | 4-({2-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene}methyl)phenyl 3-fluorobenzoate |
| Molecular Weight: | 551.53 |
| Molecular Formula: | C31 H22 F N3 O6 |
| Smiles: | C1Oc2ccc(\C=C(/C(N/N=C/c3ccc(cc3)OC(c3cccc(c3)F)=O)=O)NC(c3ccccc3)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 5.0911 |
| logD: | 3.5152 |
| logSw: | -5.2886 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.972 |
| InChI Key: | LGNUASQNSDHVCU-UHFFFAOYSA-N |