2-oxo-2-[4-(propan-2-yl)anilino]ethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-oxo-2-[4-(propan-2-yl)anilino]ethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
2-oxo-2-[4-(propan-2-yl)anilino]ethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D425-0466 |
| Compound Name: | 2-oxo-2-[4-(propan-2-yl)anilino]ethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C27 H27 N3 O3 S |
| Smiles: | CC(C)c1ccc(cc1)NC(COC(CSc1nc2ccccc2n1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4653 |
| logD: | 6.4388 |
| logSw: | -5.6861 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.161 |
| InChI Key: | MZMXKFBBYDMUKL-UHFFFAOYSA-N |