5-[(4-bromobenzene-1-sulfinyl)methyl]-N-{2-[butyl(ethyl)amino]ethyl}furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-{2-[butyl(ethyl)amino]ethyl}furan-2-carboxamide
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-{2-[butyl(ethyl)amino]ethyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-2497 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfinyl)methyl]-N-{2-[butyl(ethyl)amino]ethyl}furan-2-carboxamide |
| Molecular Weight: | 455.41 |
| Molecular Formula: | C20 H27 Br N2 O3 S |
| Smiles: | CCCCN(CC)CCNC(c1ccc(CS(c2ccc(cc2)[Br])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1614 |
| logD: | 2.7716 |
| logSw: | -3.695 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.411 |
| InChI Key: | SJOXGCXRONPNFB-UHFFFAOYSA-N |