2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Chemical Structure Depiction of
2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | V008-0138 |
| Compound Name: | 2-{[(2,3-dimethoxyphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C25 H31 N3 O6 S2 |
| Salt: | not_available |
| Smiles: | COc1cccc(CSc2nc3cc(ccc3n2CC2CCCO2)S(N2CCOCC2)(=O)=O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6735 |
| logD: | 3.6732 |
| logSw: | -3.8779 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.099 |
| InChI Key: | JKZOBQILUKHVMH-LJQANCHMSA-N |