2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 5983-1236 |
| Compound Name: | 2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 417.26 |
| Molecular Formula: | C19 H17 Br N2 O4 |
| Smiles: | CCOc1cc(c(cc1OC)C1C(C#N)=C(N)Oc2cc(ccc12)O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5439 |
| logD: | 2.5436 |
| logSw: | -2.5728 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.752 |
| InChI Key: | DBBDLFJAWJBIMQ-SFHVURJKSA-N |