Basic information
- Standard SMILES
CCOCCOCCOc1nc(Nc2cc(C)[nH]n2)cc2ccccc12- InChIKey
WSTTWMRSRQCKTB-UHFFFAOYSA-N- Molecular formula
- C19H24N4O3
- Average molar mass
- 356.4 g/mol
Names & identifiers
- Preferred name
- {-[2-(2-ethoxy-ethoxy)-ethoxy]-isoquinolin-3-yl}-(5-methyl-1H-pyrazol-3-yl)-amine
- IUPAC
- 1-[2-(2-ethoxyethoxy)ethoxy]-N-(5-methyl-1H-pyrazol-3-yl)isoquinolin-3-amine
Names & synonyms
SCHEMBL3964220WSTTWMRSRQCKTB-UHFFFAOYSA-N{-[2-(2-ethoxy-ethoxy)-ethoxy]-isoquinolin-3-yl}-(5-methyl-1H-pyrazol-3-yl)-amine
Database identifiers
- PubChem CID
- 57799867
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 81.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 401
Related reactions
2 records
Compound notes
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