2-(4-ethylanilino)-2-oxoethyl ({1-[(3-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
2-(4-ethylanilino)-2-oxoethyl ({1-[(3-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
2-(4-ethylanilino)-2-oxoethyl ({1-[(3-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D425-2797 |
| Compound Name: | 2-(4-ethylanilino)-2-oxoethyl ({1-[(3-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C27 H27 N3 O3 S |
| Smiles: | CCc1ccc(cc1)NC(COC(CSc1nc2ccccc2n1Cc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7044 |
| logD: | 6.6779 |
| logSw: | -5.6009 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.161 |
| InChI Key: | NGWUJKIFIYRXOS-UHFFFAOYSA-N |