methyl 2-[2-(2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)acetamido]benzoate
methyl 2-[2-(2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | G534-0517 |
| Compound Name: | methyl 2-[2-(2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)acetamido]benzoate |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C26 H24 N4 O4 S |
| Smiles: | COC(c1ccccc1NC(Cn1c2ccccc2nc1SCC(NCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1886 |
| logD: | 4.1549 |
| logSw: | -4.3254 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.574 |
| InChI Key: | LRDZOFDWLBRJGG-UHFFFAOYSA-N |