2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl ({1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl ({1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl ({1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D425-2645 |
| Compound Name: | 2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl ({1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C27 H27 N3 O4 S |
| Smiles: | Cc1ccccc1Cn1c2ccccc2nc1SCC(=O)OCC(NCc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5042 |
| logD: | 5.3728 |
| logSw: | -5.3793 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.027 |
| InChI Key: | WLMRBKURQDNXKA-UHFFFAOYSA-N |