3-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
Chemical Structure Depiction of
3-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
3-{2-[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]hydrazinyl}benzoic acid
Compound characteristics
| Compound ID: | 6372-3031 |
| Compound Name: | 3-{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/Nc1cccc(c1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3929 |
| logD: | -1.6893 |
| logSw: | -1.9007 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.47 |
| InChI Key: | IHWMDBJVIBBISN-UHFFFAOYSA-N |