2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 5983-1245 |
| Compound Name: | 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 417.26 |
| Molecular Formula: | C19 H17 Br N2 O4 |
| Smiles: | CCOc1cc(cc(c1OC)[Br])C1C(C#N)=C(N)Oc2cc(ccc12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1306 |
| logD: | 3.1302 |
| logSw: | -3.2833 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.838 |
| InChI Key: | BCRZIMJRBPUSJG-KRWDZBQOSA-N |