N-benzyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-1-methyl-1H-benzimidazole-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-1-methyl-1H-benzimidazole-6-carboxamide
N-benzyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-1-methyl-1H-benzimidazole-6-carboxamide
Compound characteristics
| Compound ID: | C797-0801 |
| Compound Name: | N-benzyl-2-{[(4-fluorophenyl)methyl]sulfanyl}-1-methyl-1H-benzimidazole-6-carboxamide |
| Molecular Weight: | 405.49 |
| Molecular Formula: | C23 H20 F N3 O S |
| Smiles: | Cn1c2cc(ccc2nc1SCc1ccc(cc1)F)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.488 |
| logD: | 4.4879 |
| logSw: | -4.3338 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.972 |
| InChI Key: | ZOBKEQILQBFRPM-UHFFFAOYSA-N |