5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-2386 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide |
| Molecular Weight: | 399.3 |
| Molecular Formula: | C16 H19 Br N2 O3 S |
| Smiles: | CN(C)CCNC(c1ccc(CS(c2ccc(cc2)[Br])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4609 |
| logD: | 1.3346 |
| logSw: | -2.7732 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.612 |
| InChI Key: | VKNVSSKBUNQBQZ-UHFFFAOYSA-N |