2-hydroxy-4-methyl-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-6-oxo-5,6-dihydropyridine-3-carbonitrile
Chemical Structure Depiction of
2-hydroxy-4-methyl-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-6-oxo-5,6-dihydropyridine-3-carbonitrile
2-hydroxy-4-methyl-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-6-oxo-5,6-dihydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4338-0982 |
| Compound Name: | 2-hydroxy-4-methyl-5-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-6-oxo-5,6-dihydropyridine-3-carbonitrile |
| Molecular Weight: | 363.33 |
| Molecular Formula: | C19 H13 N3 O5 |
| Smiles: | CC1/C(=C/c2ccc(c3ccc(C)cc3[N+]([O-])=O)o2)C(N=C(C=1C#N)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8231 |
| logD: | -4.486 |
| logSw: | -3.3295 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.754 |
| InChI Key: | NNYFCPFQGDTGSR-UHFFFAOYSA-N |