2-{[(3-chlorophenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V003-0688 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-1-[(oxolan-2-yl)methyl]-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 492.06 |
| Molecular Formula: | C23 H26 Cl N3 O3 S2 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nc(n2CC1CCCO1)SCc1cccc(c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9347 |
| logD: | 4.9344 |
| logSw: | -4.9831 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.209 |
| InChI Key: | BHOPUCNPZABXSJ-LJQANCHMSA-N |