5-nitro-1H-benzimidazole-2-thiol
Chemical Structure Depiction of
5-nitro-1H-benzimidazole-2-thiol
5-nitro-1H-benzimidazole-2-thiol
Compound characteristics
| Compound ID: | 0781-2611 |
| Compound Name: | 5-nitro-1H-benzimidazole-2-thiol |
| Molecular Weight: | 195.2 |
| Molecular Formula: | C7 H5 N3 O2 S |
| Smiles: | c1cc2c(cc1[N+]([O-])=O)nc([nH]2)S |
| Stereo: | ACHIRAL |
| logP: | 1.7248 |
| logD: | 1.715 |
| logSw: | -2.0757 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.51 |
| InChI Key: | YPXQSGWOGQPLQO-UHFFFAOYSA-N |