methyl 3-methoxy-4-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzoate
Chemical Structure Depiction of
methyl 3-methoxy-4-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzoate
methyl 3-methoxy-4-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzoate
Compound characteristics
| Compound ID: | V006-9294 |
| Compound Name: | methyl 3-methoxy-4-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzoate |
| Molecular Weight: | 545.68 |
| Molecular Formula: | C26 H31 N3 O6 S2 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(CSc2nc3cc(ccc3n2CC2CCCO2)S(N2CCCC2)(=O)=O)c(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5573 |
| logD: | 4.5571 |
| logSw: | -4.4796 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 80.013 |
| InChI Key: | BCEWCNGWYQSPHH-HXUWFJFHSA-N |