2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1-phenyl-1H-benzimidazole
Chemical Structure Depiction of
2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1-phenyl-1H-benzimidazole
2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1-phenyl-1H-benzimidazole
Compound characteristics
| Compound ID: | 3510-0002 |
| Compound Name: | 2-{[(6-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1-phenyl-1H-benzimidazole |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C21 H15 N5 O2 S |
| Smiles: | C(c1nc2ccc(cc2[nH]1)[N+]([O-])=O)Sc1nc2ccccc2n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3189 |
| logD: | 5.1985 |
| logSw: | -5.7316 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.884 |
| InChI Key: | OHWRNIULPIKYMQ-UHFFFAOYSA-N |