Basic information
- CAS
27784-55-0- Standard SMILES
O=C(CSc1nc2ccccc2[nH]1)C1CC1- InChIKey
ATVWSZHDXNJBDB-UHFFFAOYSA-N- Molecular formula
- C12H12N2OS
- Average molar mass
- 232.3 g/mol
- Monoisotopic mass
- 232.06703418
Names & identifiers
- Preferred name
- 2-(1H-benzimidazol-2-ylsulfanyl)-1-cyclopropylethanone
- IUPAC
- 2-(1H-benzimidazol-2-ylsulfanyl)-1-cyclopropylethanone
Names & synonyms
27784-55-02-(1H-benzimidazol-2-ylsulfanyl)-1-cyclopropylethanoneDTXSID30350686RefChem:249903DTXCID703017532-(1H-BENZIMIDAZOL-2-YLTHIO)-1-CYCLOPROPYLETHANONE2-((1H-Benzo[d]imidazol-2-yl)thio)-1-cyclopropylethanoneMFCD015743582-((1H-benzo[d]imidazol-2-yl)thio)-1-cyclopropylethan-1-oneEthanone, 2-(1H-benzimidazol-2-ylthio)-1-cyclopropyl-2-(1H-1,3-BENZODIAZOL-2-YLSULFANYL)-1-CYCLOPROPYLETHANONECHEMBRDG-BB 5927631
Show more names
TimTec1_004352Oprea1_461861Oprea1_782222HMS1546F18AKOS000575030BS-35883ST4050789CS-0323812
Database identifiers
- CAS
27784-55-0- PubChem CID
- 686010
- DTXSID
DTXSID30350686
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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