2-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
Chemical Structure Depiction of
2-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
2-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
Compound characteristics
| Compound ID: | 5646-1354 |
| Compound Name: | 2-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid |
| Molecular Weight: | 342.31 |
| Molecular Formula: | C16 H14 N4 O5 |
| Smiles: | CC1=C(C#N)C(N(CCO)C(C/1=N/Nc1ccccc1C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6098 |
| logD: | -1.9325 |
| logSw: | -2.2382 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.772 |
| InChI Key: | QEZDAOFOVCKZHQ-UHFFFAOYSA-N |