Basic information
- CAS
843635-42-7- Standard SMILES
CCCn1nc(NC(=O)c2ccco2)c2cc3cc(C)ccc3nc21- InChIKey
QRGKWXHZWFMTHW-UHFFFAOYSA-N- Molecular formula
- C19H18N4O2
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.14297583
Names & identifiers
- Preferred name
- N-(6-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamide
- IUPAC
- N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
Names & synonyms
N-(6-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamideN-(6-methyl-1-propyl-1H-pyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamide843635-42-7MLS000770017CHEMBL1300803DTXSID901330409HMS2788H09STK726353AKOS003657104SMR000434750Furan-2-carboxylic acid (6-methyl-1-propyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-amide
Database identifiers
- CAS
843635-42-7- PubChem CID
- 934278
- DTXSID
DTXSID901330409- ChEMBL
CHEMBL1300803
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 488
Experimental & physicochemical properties
Solubility1.2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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