2-amino-4-(3-bromo-4,5-diethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3-bromo-4,5-diethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
2-amino-4-(3-bromo-4,5-diethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 5983-1246 |
| Compound Name: | 2-amino-4-(3-bromo-4,5-diethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 431.28 |
| Molecular Formula: | C20 H19 Br N2 O4 |
| Smiles: | CCOc1cc(cc(c1OCC)[Br])C1C(C#N)=C(N)Oc2cc(ccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5612 |
| logD: | 3.5609 |
| logSw: | -3.8411 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.418 |
| InChI Key: | QDNYYSKSAQKCQC-SFHVURJKSA-N |