Basic information
- Standard SMILES
N#Cc1cnn2c(NC3CC3)cc(-n3ccc4ccc(CO)cc43)nc12- InChIKey
UYYKRBTVNGXKAC-UHFFFAOYSA-N- Molecular formula
- C19H16N6O
- Average molar mass
- 344.4 g/mol
Names & identifiers
- Preferred name
- 7-(Cyclopropylamino)-5-[6-(hydroxymethyl)indol-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
- IUPAC
- 7-(cyclopropylamino)-5-[6-(hydroxymethyl)indol-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Names & synonyms
CHEMBL2062578SCHEMBL17502149BDBM50388793
Database identifiers
- PubChem CID
- 70692775
- ChEMBL
CHEMBL2062578
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 574
Experimental & physicochemical properties
LogP3.09
Related reactions
1 records
Linked notes
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