N-[1-(2H-1,3-benzodioxol-5-yl)-3-{2-[(5-bromo-2-hydroxy-3-methylphenyl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)-3-{2-[(5-bromo-2-hydroxy-3-methylphenyl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
N-[1-(2H-1,3-benzodioxol-5-yl)-3-{2-[(5-bromo-2-hydroxy-3-methylphenyl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 8002-1594 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)-3-{2-[(5-bromo-2-hydroxy-3-methylphenyl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 522.35 |
| Molecular Formula: | C25 H20 Br N3 O5 |
| Smiles: | Cc1cc(cc(/C=N/NC(/C(=C/c2ccc3c(c2)OCO3)NC(c2ccccc2)=O)=O)c1O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.2883 |
| logD: | 3.7124 |
| logSw: | -5.2734 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.073 |
| InChI Key: | AWUDRYMOTGPNEY-UHFFFAOYSA-N |