Basic information
- CAS
6967-55-1- Standard SMILES
Cc1ccnc(Nc2nc3ccccc3[nH]2)n1- InChIKey
SJVBZTHEVJPABX-UHFFFAOYSA-N- Molecular formula
- C12H11N5
- Average molar mass
- 225.25 g/mol
- Monoisotopic mass
- 225.10144537
Names & identifiers
- Preferred name
- n-(4-Methylpyrimidin-2-yl)-1h-benzimidazol-2-amine
- IUPAC
- N-(4-methylpyrimidin-2-yl)-1H-benzimidazol-2-amine
Names & synonyms
6967-55-1NSC 67303n-(4-methylpyrimidin-2-yl)-1h-benzimidazol-2-amineNSC67303DTXSID00290202NSC-67303N-(4-Methylpyrimidin-2-yl)-1H-1,3-benzimidazol-2-amine
Database identifiers
- CAS
6967-55-1- PubChem CID
- 249240
- DTXSID
DTXSID00290202
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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