7-(Methanesulfonyl)-2-(oxolan-2-yl)-1H-benzimidazole
Basic information
- CAS
1547913-77-8- Standard SMILES
CS(=O)(=O)c1cccc2[nH]c(C3CCCO3)nc12- InChIKey
IQOFLUHLHWUZLQ-UHFFFAOYSA-N- Molecular formula
- C12H14N2O3S
- Average molar mass
- 266.32 g/mol
- Monoisotopic mass
- 266.07251349
Names & identifiers
- Preferred name
- 7-(Methanesulfonyl)-2-(oxolan-2-yl)-1H-benzimidazole
- IUPAC
- 4-methylsulfonyl-2-(oxolan-2-yl)-1H-benzimidazole
Names & synonyms
DTXSID601178305AKOS0209908037-(Methanesulfonyl)-2-(oxolan-2-yl)-1H-benzimidazole1H-Benzimidazole, 7-(methylsulfonyl)-2-(tetrahydro-2-furanyl)-1547913-77-8
Database identifiers
- CAS
1547913-77-8- PubChem CID
- 82008192
- DTXSID
DTXSID601178305
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 80.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 406
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Compound notes
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