1-(3-nitrobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
1-(3-nitrobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
1-(3-nitrobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | K653-0173 |
| Compound Name: | 1-(3-nitrobenzene-1-sulfonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-1H-benzimidazole |
| Molecular Weight: | 470.48 |
| Molecular Formula: | C20 H14 N4 O6 S2 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)Sc1nc2ccccc2n1S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9083 |
| logD: | 4.9083 |
| logSw: | -5.0169 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 103.627 |
| InChI Key: | AHDHZMOFJQAADP-UHFFFAOYSA-N |