2-amino-6-(hydroxymethyl)-4-(2-nitrophenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-6-(hydroxymethyl)-4-(2-nitrophenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
2-amino-6-(hydroxymethyl)-4-(2-nitrophenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 6114-0020 |
| Compound Name: | 2-amino-6-(hydroxymethyl)-4-(2-nitrophenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile |
| Molecular Weight: | 341.28 |
| Molecular Formula: | C16 H11 N3 O6 |
| Smiles: | C(C1=CC(C2=C(C(C(C#N)=C(N)O2)c2ccccc2[N+]([O-])=O)O1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6169 |
| logD: | 0.6169 |
| logSw: | -1.5679 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 119.79 |
| InChI Key: | YYZJHCHFUGRDDU-ZDUSSCGKSA-N |