2-{[(2-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(2-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
2-{[(2-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V017-9617 |
| Compound Name: | 2-{[(2-methylphenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 471.64 |
| Molecular Formula: | C24 H29 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1CSc1nc2cc(ccc2n1CC1CCCO1)S(N1CCCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0794 |
| logD: | 5.0778 |
| logSw: | -4.8932 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.209 |
| InChI Key: | XZFZSKLUOPRJSK-HXUWFJFHSA-N |