N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
Basic information
- CAS
579446-12-1- Standard SMILES
CC(C)Cn1nc(NC(=O)c2ccco2)c2cc3ccccc3nc21- InChIKey
JGBDZNPMGVLDLF-UHFFFAOYSA-N- Molecular formula
- C19H18N4O2
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.14297583
Names & identifiers
- Preferred name
- N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
- IUPAC
- N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
Names & synonyms
N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide579446-12-1N-(1-isobutyl-1H-pyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamideN-[1-(2-methylpropyl)-1H-pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamideMLS000769844CHEMBL1484695DTXSID601330400HMS2806A16STK726435AKOS003655930SMR000434577BRD-K89813314-001-07-1
Show more names
Furan-2-carboxylic acid (1-isobutyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-amide
Database identifiers
- CAS
579446-12-1- PubChem CID
- 938552
- DTXSID
DTXSID601330400- ChEMBL
CHEMBL1484695
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 486
Experimental & physicochemical properties
Solubility0.7 [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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