5-(2,5-dimethyl-3-{[2-(pyridine-3-carbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-(2,5-dimethyl-3-{[2-(pyridine-3-carbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzene-1,3-dicarboxylic acid
5-(2,5-dimethyl-3-{[2-(pyridine-3-carbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 4764-3540 |
| Compound Name: | 5-(2,5-dimethyl-3-{[2-(pyridine-3-carbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 406.4 |
| Molecular Formula: | C21 H18 N4 O5 |
| Smiles: | Cc1cc(/C=N/NC(c2cccnc2)=O)c(C)n1c1cc(cc(c1)C(O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7188 |
| logD: | -2.3911 |
| logSw: | -2.7702 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.553 |
| InChI Key: | XDQKCAWQHDLFBJ-UHFFFAOYSA-N |