2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D425-0485 |
| Compound Name: | 2-{[(3-methoxyphenyl)methyl]amino}-2-oxoethyl [(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C26 H25 N3 O4 S |
| Smiles: | COc1cccc(CNC(COC(CSc2nc3ccccc3n2Cc2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7479 |
| logD: | 4.7214 |
| logSw: | -4.596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.027 |
| InChI Key: | GVUBUCNDKZXFDA-UHFFFAOYSA-N |