2-(3,4-dimethylphenoxy)-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
2-(3,4-dimethylphenoxy)-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D425-0504 |
| Compound Name: | 2-(3,4-dimethylphenoxy)-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C26 H24 N2 O4 S |
| Smiles: | Cc1ccc(cc1C)OC(COC(CSc1nc2ccccc2n1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0171 |
| logD: | 5.9906 |
| logSw: | -5.4258 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.066 |
| InChI Key: | LNRKIADOFXWQKQ-UHFFFAOYSA-N |