5-methoxy-2-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1H-benzimidazole
Chemical Structure Depiction of
5-methoxy-2-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1H-benzimidazole
5-methoxy-2-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | 8007-4807 |
| Compound Name: | 5-methoxy-2-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1H-benzimidazole |
| Molecular Weight: | 369.32 |
| Molecular Formula: | C15 H10 F3 N3 O3 S |
| Smiles: | COc1ccc2c(c1)nc([nH]2)Sc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.6674 |
| logD: | 4.6527 |
| logSw: | -4.6064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.604 |
| InChI Key: | CSPMYLKWPRIKHY-UHFFFAOYSA-N |