5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(4-methylpiperazin-1-yl)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(4-methylpiperazin-1-yl)ethyl]furan-2-carboxamide
5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(4-methylpiperazin-1-yl)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | E535-2509 |
| Compound Name: | 5-[(4-bromobenzene-1-sulfinyl)methyl]-N-[2-(4-methylpiperazin-1-yl)ethyl]furan-2-carboxamide |
| Molecular Weight: | 454.38 |
| Molecular Formula: | C19 H24 Br N3 O3 S |
| Smiles: | CN1CCN(CCNC(c2ccc(CS(c3ccc(cc3)[Br])=O)o2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.1107 |
| logD: | 1.4432 |
| logSw: | -2.8363 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.934 |
| InChI Key: | KNIBYJCESZJNLG-UHFFFAOYSA-N |