3-(3-bromo-4-hydroxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-(3-bromo-4-hydroxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-(3-bromo-4-hydroxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0406 |
| Compound Name: | 3-(3-bromo-4-hydroxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 348.15 |
| Molecular Formula: | C14 H10 Br N3 O3 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(c(c2)[Br])O)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.17 |
| logD: | 1.65 |
| logSw: | -3.87 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 187.1 |
| InChI Key: | HKAXIVFMUNJAGM-UHFFFAOYSA-N |