5-(hydroxymethylidene)-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-(hydroxymethylidene)-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
5-(hydroxymethylidene)-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | Y508-0570 |
| Compound Name: | 5-(hydroxymethylidene)-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 192.17 |
| Molecular Formula: | C9 H8 N2 O3 |
| Smiles: | CC1/C(=C/O)C(N(C)C(C=1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.9219 |
| logD: | -3.3224 |
| logSw: | 0.2542 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.965 |
| InChI Key: | ZKUYXRBPWBIVTI-UHFFFAOYSA-N |