ethyl 5-[(6-{[2-(5-fluoro-1H-indole-2-carbonyl)hydrazinylidene]methyl}-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(6-{[2-(5-fluoro-1H-indole-2-carbonyl)hydrazinylidene]methyl}-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
ethyl 5-[(6-{[2-(5-fluoro-1H-indole-2-carbonyl)hydrazinylidene]methyl}-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | 8019-6862 |
| Compound Name: | ethyl 5-[(6-{[2-(5-fluoro-1H-indole-2-carbonyl)hydrazinylidene]methyl}-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 540.5 |
| Molecular Formula: | C26 H25 F N4 O8 |
| Smiles: | CCOC(C1CC(Cc2c(\C=N/NC(c3cc4cc(ccc4[nH]3)F)=O)c(c3c(c2OC)OCO3)OC)ON=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7867 |
| logD: | 4.7864 |
| logSw: | -4.7693 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.411 |
| InChI Key: | ZSOHTBNYCBXIQM-HNNXBMFYSA-N |