1-methyl-2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
1-methyl-2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1H-benzimidazole
1-methyl-2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1H-benzimidazole
Compound characteristics
Compound ID: | 8010-5463 |
Compound Name: | 1-methyl-2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1H-benzimidazole |
Molecular Weight: | 339.37 |
Molecular Formula: | C16 H13 N5 O2 S |
Smiles: | Cn1c2ccccc2nc1SCc1nc2ccc(cc2[nH]1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.9461 |
logD: | 3.6815 |
logSw: | -4.0682 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.222 |
InChI Key: | MUUMZRXVFYKALA-UHFFFAOYSA-N |