2-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
Chemical Structure Depiction of
2-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
2-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile
Compound characteristics
| Compound ID: | V016-9849 |
| Compound Name: | 2-[({1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazol-2-yl}sulfanyl)methyl]benzonitrile |
| Molecular Weight: | 482.62 |
| Molecular Formula: | C24 H26 N4 O3 S2 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nc(n2CC1CCCO1)SCc1ccccc1C#N)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0817 |
| logD: | 4.0814 |
| logSw: | -4.2365 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.265 |
| InChI Key: | ACEQRTSJKRUMDN-HXUWFJFHSA-N |