ethyl 1-[2-(4-methoxyphenyl)ethyl]-2-{[(pentamethylphenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(4-methoxyphenyl)ethyl]-2-{[(pentamethylphenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
ethyl 1-[2-(4-methoxyphenyl)ethyl]-2-{[(pentamethylphenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V009-0259 |
| Compound Name: | ethyl 1-[2-(4-methoxyphenyl)ethyl]-2-{[(pentamethylphenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 516.7 |
| Molecular Formula: | C31 H36 N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2CCc1ccc(cc1)OC)SCc1c(C)c(C)c(C)c(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 9.0745 |
| logD: | 9.0445 |
| logSw: | -5.6814 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.753 |
| InChI Key: | ACUABUXIDHKPMY-UHFFFAOYSA-N |