2,4-diamino-5-(2,4-dimethoxyphenyl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2,4-diamino-5-(2,4-dimethoxyphenyl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
2,4-diamino-5-(2,4-dimethoxyphenyl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-6713 |
| Compound Name: | 2,4-diamino-5-(2,4-dimethoxyphenyl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile |
| Molecular Weight: | 390.4 |
| Molecular Formula: | C21 H18 N4 O4 |
| Smiles: | COc1ccc(C2c3ccc(cc3Oc3c2c(c(C#N)c(N)n3)N)O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7407 |
| logD: | 2.7171 |
| logSw: | -3.0939 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 106.246 |
| InChI Key: | IWGBJRKZJCEANA-QGZVFWFLSA-N |