Basic information
- CAS
84637-33-2- Standard SMILES
N#Cc1c(N)nc2c(c(-c3ccc(Cl)cc3)nn2-c2ccccc2)c1C#N- InChIKey
HGJUFGNYNNAFMG-UHFFFAOYSA-N- Molecular formula
- C20H11ClN6
- Average molar mass
- 370.8 g/mol
- Monoisotopic mass
- 370.0733721
Names & identifiers
- Preferred name
- 6-Amino-3-(4-chlorophenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4,5-dicarbonitrile
- IUPAC
- 6-amino-3-(4-chlorophenyl)-1-phenylpyrazolo[5,4-b]pyridine-4,5-dicarbonitrile
Names & synonyms
84637-33-26-Amino-3-(4-chlorophenyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4,5-dicarbonitrileNSC3775286-Amino-3-(4-chlorophenyl)-1-phenyl-1H-pyrazolo(3,4-b)pyridine-4,5-dicarbonitrileNSC-377528NSC 377528NUG4NB9MKEDTXSID202336361H-Pyrazolo[3,4-b]pyridine-4,5-dicarbonitrile, 6-amino-3-(4-chlorophenyl)-1-phenyl-6-amino-3-(4-chlorophenyl)-1-phenyl-pyrazolo[3,4-b]pyridine-4,5-dicarbonitrile
Database identifiers
- CAS
84637-33-2- PubChem CID
- 342135
- DTXSID
DTXSID20233636- UNII
- NUG4NB9MKE
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 623
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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