methyl {2-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1H-benzimidazol-1-yl}acetate
Chemical Structure Depiction of
methyl {2-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1H-benzimidazol-1-yl}acetate
methyl {2-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1H-benzimidazol-1-yl}acetate
Compound characteristics
| Compound ID: | 4114-0081 |
| Compound Name: | methyl {2-[2-(4-chlorobenzene-1-sulfonyl)ethyl]-1H-benzimidazol-1-yl}acetate |
| Molecular Weight: | 392.86 |
| Molecular Formula: | C18 H17 Cl N2 O4 S |
| Smiles: | COC(Cn1c2ccccc2nc1CCS(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0957 |
| logD: | 2.9828 |
| logSw: | -3.5072 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.758 |
| InChI Key: | OHJLERIFHFCJJK-UHFFFAOYSA-N |