ethyl 5-{[4,7-dimethoxy-6-({2-[4-(methoxymethyl)-6-methyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]hydrazinylidene}methyl)-2H-1,3-benzodioxol-5-yl]methyl}-4,5-dihydro-1,2-oxazole-3-carboxyla te
Chemical Structure Depiction of
ethyl 5-{[4,7-dimethoxy-6-({2-[4-(methoxymethyl)-6-methyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]hydrazinylidene}methyl)-2H-1,3-benzodioxol-5-yl]methyl}-4,5-dihydro-1,2-oxazole-3-carboxyla te
ethyl 5-{[4,7-dimethoxy-6-({2-[4-(methoxymethyl)-6-methyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]hydrazinylidene}methyl)-2H-1,3-benzodioxol-5-yl]methyl}-4,5-dihydro-1,2-oxazole-3-carboxyla te
Compound characteristics
| Compound ID: | 8020-5587 |
| Compound Name: | ethyl 5-{[4,7-dimethoxy-6-({2-[4-(methoxymethyl)-6-methyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]hydrazinylidene}methyl)-2H-1,3-benzodioxol-5-yl]methyl}-4,5-dihydro-1,2-oxazole-3-carboxyla te |
| Molecular Weight: | 663.71 |
| Molecular Formula: | C32 H33 N5 O9 S |
| Smiles: | CCOC(C1CC(Cc2c(/C=N/NC(c3c(c4c(COC)cc(C)nc4s3)n3cccc3)=O)c(c3c(c2OC)OCO3)OC)ON=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4663 |
| logD: | 5.4652 |
| logSw: | -5.4975 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 132.397 |
| InChI Key: | AZARGHKBFAZIOK-IBGZPJMESA-N |