5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[(4-ethoxyphenyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[(4-ethoxyphenyl)methyl]furan-2-carboxamide
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[(4-ethoxyphenyl)methyl]furan-2-carboxamide
Compound characteristics
Compound ID: | E535-2542 |
Compound Name: | 5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[(4-ethoxyphenyl)methyl]furan-2-carboxamide |
Molecular Weight: | 462.36 |
Molecular Formula: | C21 H20 Br N O4 S |
Smiles: | CCOc1ccc(CNC(c2ccc(CS(c3ccc(cc3)[Br])=O)o2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.494 |
logD: | 4.494 |
logSw: | -4.1871 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.757 |
InChI Key: | VEUNLMQPIZNSFC-UHFFFAOYSA-N |