5-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Chemical Structure Depiction of
5-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
5-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Compound characteristics
| Compound ID: | 8012-2610 |
| Compound Name: | 5-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline |
| Molecular Weight: | 521.39 |
| Molecular Formula: | C21 H21 Br N4 O5 S |
| Smiles: | C(c1ccco1)Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7358 |
| logD: | 4.7358 |
| logSw: | -4.7916 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.576 |
| InChI Key: | UXNFSZCVQBLYRJ-UHFFFAOYSA-N |