1-(4-bromobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
1-(4-bromobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
1-(4-bromobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | K653-0187 |
| Compound Name: | 1-(4-bromobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole |
| Molecular Weight: | 504.38 |
| Molecular Formula: | C20 H14 Br N3 O4 S2 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)Sc1nc2ccccc2n1S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8818 |
| logD: | 5.8818 |
| logSw: | -6.0642 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.245 |
| InChI Key: | DSYHBAIVXGHVIL-UHFFFAOYSA-N |