N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-0495 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 455.57 |
| Molecular Formula: | C25 H29 N O5 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(CS(c3cccc(C)c3)=O)o2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.587 |
| logD: | 3.587 |
| logSw: | -3.7157 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.896 |
| InChI Key: | JMHKIJJAGZRIRW-UHFFFAOYSA-N |