Basic information
- Standard SMILES
Cl.NCCCNCc1ccc(-c2cn3cc[nH]c3nc2=O)cc1- InChIKey
CNVKTORUVYQKFP-UHFFFAOYSA-N- Molecular formula
- C16H20ClN5O
- Average molar mass
- 333.81 g/mol
- Monoisotopic mass
- 333.135638
Names & identifiers
- Preferred name
- 6-{4-[(3-Amino-propylamino)-methyl]-phenyl}-1H-imidazo[1,2-a]pyrimidin-7-one hydrochloride salt
- IUPAC
- 6-[4-[(3-aminopropylamino)methyl]phenyl]-8H-imidazo[1,2-a]pyrimidin-7-one;hydrochloride
Names & synonyms
SCHEMBL9037CNVKTORUVYQKFP-UHFFFAOYSA-N6-{4-[(3-Amino-propylamino)-methyl]-phenyl}-1H-imidazo[1,2-a]pyrimidin-7-one hydrochloride salt
Database identifiers
- PubChem CID
- 66579163
Properties
Computed structural properties
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 417
Related reactions
1 records
Compound notes
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