2-[2-cyano-3-(pyridin-3-yl)prop-2-enamido]benzoic acid
Chemical Structure Depiction of
2-[2-cyano-3-(pyridin-3-yl)prop-2-enamido]benzoic acid
2-[2-cyano-3-(pyridin-3-yl)prop-2-enamido]benzoic acid
Compound characteristics
| Compound ID: | Y505-4708 |
| Compound Name: | 2-[2-cyano-3-(pyridin-3-yl)prop-2-enamido]benzoic acid |
| Molecular Weight: | 293.28 |
| Molecular Formula: | C16 H11 N3 O3 |
| Smiles: | C(=C(/C#N)C(Nc1ccccc1C(O)=O)=O)/c1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5729 |
| logD: | -1.8444 |
| logSw: | -2.8378 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.614 |
| InChI Key: | TYSPKTQSWCOPEQ-UHFFFAOYSA-N |