5-cyano-2-ethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
Chemical Structure Depiction of
5-cyano-2-ethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
5-cyano-2-ethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | C202-3551 |
| Compound Name: | 5-cyano-2-ethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid |
| Molecular Weight: | 192.17 |
| Molecular Formula: | C9 H8 N2 O3 |
| Smiles: | CCC1=C(C=C(C#N)C(N1)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1865 |
| logD: | -6.4128 |
| logSw: | -1.5423 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.839 |
| InChI Key: | XAACQPZGKRHEOD-UHFFFAOYSA-N |