2-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
2-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | G534-2994 |
| Compound Name: | 2-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C25 H23 F N4 O3 S |
| Smiles: | COc1ccc(CNC(Cn2c3ccccc3nc2SCC(Nc2ccc(cc2)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3719 |
| logD: | 4.3716 |
| logSw: | -4.3104 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.642 |
| InChI Key: | ZPINDDBQBJWZIQ-UHFFFAOYSA-N |