2,4-diamino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2,4-diamino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
2,4-diamino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-6805 |
| Compound Name: | 2,4-diamino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-hydroxy-5H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C21 H16 N4 O4 |
| Smiles: | C1COc2cc(ccc2O1)C1c2ccc(cc2Oc2c1c(c(C#N)c(N)n2)N)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7691 |
| logD: | 1.7455 |
| logSw: | -2.0688 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 106.895 |
| InChI Key: | UUNCZRYDXLWDBR-KRWDZBQOSA-N |