N-[(2,3-dimethoxyphenyl)methyl]-5-[(4-fluorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-5-[(4-fluorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
N-[(2,3-dimethoxyphenyl)methyl]-5-[(4-fluorobenzene-1-sulfinyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-4311 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-5-[(4-fluorobenzene-1-sulfinyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 417.45 |
| Molecular Formula: | C21 H20 F N O5 S |
| Smiles: | COc1cccc(CNC(c2ccc(CS(c3ccc(cc3)F)=O)o2)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4612 |
| logD: | 3.4612 |
| logSw: | -3.7499 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.981 |
| InChI Key: | YEOIIIJRIACYSQ-UHFFFAOYSA-N |