4-[1-(3-Methyl-butyl)-1H-benzoimidazol-2-yl]-furazan-3-ylamine
Basic information
- CAS
5169-63-1- Standard SMILES
CC(C)CCn1c(-c2nonc2N)nc2ccccc21- InChIKey
WMKJVBKGTSRIQT-UHFFFAOYSA-N- Molecular formula
- C14H17N5O
- Average molar mass
- 271.32 g/mol
- Monoisotopic mass
- 271.14331018
Names & identifiers
- Preferred name
- 4-[1-(3-Methyl-butyl)-1H-benzoimidazol-2-yl]-furazan-3-ylamine
- IUPAC
- 4-[1-(3-methylbutyl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
Names & synonyms
4-[1-(3-Methyl-butyl)-1H-benzoimidazol-2-yl]-furazan-3-ylamine5169-63-1MLS000121028SCHEMBL1905525CHEMBL1540268REGID_for_CID_747997DTXSID50353679HMS2337B11AKOS000626560CCG-115206SMR000118486EU-0015657
Show more names
4-[1-(3-Methylbutyl)-1H-1,3-benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
Database identifiers
- CAS
5169-63-1- PubChem CID
- 747997
- DTXSID
DTXSID50353679- ChEMBL
CHEMBL1540268
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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