n-(3-Chlorophenyl)-1-(4-chlorophenyl)-6-methyl-1h-pyrazolo[3,4-d]pyrimidin-4-amine
Basic information
- CAS
5346-51-0- Standard SMILES
Cc1nc(Nc2cccc(Cl)c2)c2cnn(-c3ccc(Cl)cc3)c2n1- InChIKey
BZXRZOMGMLZNQM-UHFFFAOYSA-N- Molecular formula
- C18H13Cl2N5
- Average molar mass
- 370.2 g/mol
- Monoisotopic mass
- 369.0548008
Names & identifiers
- Preferred name
- n-(3-Chlorophenyl)-1-(4-chlorophenyl)-6-methyl-1h-pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- N-(3-chlorophenyl)-1-(4-chlorophenyl)-6-methylpyrazolo[3,4-d]pyrimidin-4-amine
Names & synonyms
n-(3-chlorophenyl)-1-(4-chlorophenyl)-6-methyl-1h-pyrazolo[3,4-d]pyrimidin-4-amine5346-51-0NSC1626SCHEMBL2682139DTXSID10277307NSC-16264-(3-CHLOROANILINO)-1-(4-CHLOROPHENYL)-6-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDINE
Database identifiers
- CAS
5346-51-0- PubChem CID
- 219846
- DTXSID
DTXSID10277307
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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