3-(5-bromo-2-hydroxyphenyl)-2-cyano-N-[(4-methoxyphenyl)methyl]prop-2-enamide
Chemical Structure Depiction of
3-(5-bromo-2-hydroxyphenyl)-2-cyano-N-[(4-methoxyphenyl)methyl]prop-2-enamide
3-(5-bromo-2-hydroxyphenyl)-2-cyano-N-[(4-methoxyphenyl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | K781-0807 |
| Compound Name: | 3-(5-bromo-2-hydroxyphenyl)-2-cyano-N-[(4-methoxyphenyl)methyl]prop-2-enamide |
| Molecular Weight: | 387.23 |
| Molecular Formula: | C18 H15 Br N2 O3 |
| Smiles: | COc1ccc(CNC(C(=C\c2cc(ccc2O)[Br])\C#N)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5207 |
| logD: | 3.1653 |
| logSw: | -3.4953 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.8 |
| InChI Key: | ZCKGATLYRMVSRD-UHFFFAOYSA-N |