2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | V011-7989 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole |
| Molecular Weight: | 526.05 |
| Molecular Formula: | C23 H25 Cl F N3 O4 S2 |
| Salt: | not_available |
| Smiles: | C1CC(Cn2c3ccc(cc3nc2SCc2ccc(cc2[Cl])F)S(N2CCOCC2)(=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5199 |
| logD: | 4.5197 |
| logSw: | -4.5327 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.751 |
| InChI Key: | SQPDGTXJQDXLFT-UHFFFAOYSA-N |