5-[(benzenesulfinyl)methyl]-N-[(5-bromo-2-methoxyphenyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(benzenesulfinyl)methyl]-N-[(5-bromo-2-methoxyphenyl)methyl]furan-2-carboxamide
5-[(benzenesulfinyl)methyl]-N-[(5-bromo-2-methoxyphenyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-2844 |
| Compound Name: | 5-[(benzenesulfinyl)methyl]-N-[(5-bromo-2-methoxyphenyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 448.33 |
| Molecular Formula: | C20 H18 Br N O4 S |
| Smiles: | COc1ccc(cc1CNC(c1ccc(CS(c2ccccc2)=O)o1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9994 |
| logD: | 3.9994 |
| logSw: | -4.1817 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.264 |
| InChI Key: | YLWVYLXOTZRTEQ-UHFFFAOYSA-N |