2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[(3-methylphenyl)methyl]-1H-benzimidazole-6-carboxylic acid
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[(3-methylphenyl)methyl]-1H-benzimidazole-6-carboxylic acid
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[(3-methylphenyl)methyl]-1H-benzimidazole-6-carboxylic acid
Compound characteristics
| Compound ID: | C797-0364 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[(3-methylphenyl)methyl]-1H-benzimidazole-6-carboxylic acid |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C23 H19 F N2 O2 S |
| Smiles: | Cc1cccc(Cn2c3cc(ccc3nc2SCc2ccc(cc2)F)C(O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1695 |
| logD: | 4.0569 |
| logSw: | -5.3117 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.886 |
| InChI Key: | NUWOAIVNYPAUFE-UHFFFAOYSA-N |