ethyl 5-[(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate
ethyl 5-[(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G534-2539 |
| Compound Name: | ethyl 5-[(2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-1H-benzimidazol-1-yl)methyl]-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 466.51 |
| Molecular Formula: | C23 H22 N4 O5 S |
| Smiles: | CCOC(c1cc(Cn2c3ccccc3nc2SCC(Nc2ccc(cc2)OC)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4192 |
| logD: | 4.4189 |
| logSw: | -4.2874 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.901 |
| InChI Key: | KSMKXGXAQAIKCB-UHFFFAOYSA-N |