Acetamide, N-(5,6-dimethoxy-2-benzimidazolyl)-
Basic information
- CAS
35642-71-8- Standard SMILES
COc1cc2nc(NC(C)=O)[nH]c2cc1OC- InChIKey
ZELQVTZQNMYOJS-UHFFFAOYSA-N- Molecular formula
- C11H13N3O3
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.09569129
Names & identifiers
- Preferred name
- Acetamide, N-(5,6-dimethoxy-2-benzimidazolyl)-
- IUPAC
- N-(5,6-dimethoxy-1H-benzimidazol-2-yl)acetamide
- English name
- N-(5,6-Dimethoxy-1H-benzimidazol-2-yl)acetamide
- Molecular formula
- C11H13N3O3
- Molecular weight
- 235.24
Names & synonyms
BRN 0663943ACETAMIDE, N-(5,6-DIMETHOXY-2-BENZIMIDAZOLYL)-35642-71-8N-(5,6-Dimethoxy-2-benzimidazolyl)acetamideDTXSID701891545-25-13-00329 (Beilstein Handbook Reference)RefChem:315419DTXCID00111645N-(5,6-Dimethoxy-1H-1,3-benzimidazol-2-yl)acetamideN-(5,6-Dimethoxy-1H-benzimidazol-2-yl)acetamideAcetamide, N-(5,6-dimethoxy-1H-benzimidazol-2-yl)-
Database identifiers
- CAS
35642-71-8- PubChem CID
- 37203
- DTXSID
DTXSID70189154- Nikkaji
- J72.566H
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 287
Physicochemical properties
- Density
- 1.335 · 1.335±0.06 g/cm3(Predicted)
- pka
- 8.86 · 8.86±0.10(Predicted)
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Compound notes
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