Basic information
- CAS
489410-50-6- Standard SMILES
Cc1nn(C)cc1CNC(=O)c1nn2c(C(F)(F)F)cc(-c3ccc(Br)cc3)nc2c1Cl- InChIKey
NSOUBWCPOYTFEG-UHFFFAOYSA-N- Molecular formula
- C20H15BrClF3N6O
- Average molar mass
- 527.7 g/mol
- Monoisotopic mass
- 526.01313
Names & identifiers
- Preferred name
- 5-(4-bromophenyl)-3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
- IUPAC
- 5-(4-bromophenyl)-3-chloro-N-[(1,3-dimethylpyrazol-4-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
- English name
- 5-(4-bromophenyl)-3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
- Molecular formula
- C20H15BrClF3N6O
- Molecular weight
- 527.7249096
Names & synonyms
5-(4-bromophenyl)-3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide5-(4-bromophenyl)-3-chloro-N-[(1,3-dimethylpyrazol-4-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamideAK-968/15359273STK959018AKOS003921325489410-50-6
Database identifiers
- CAS
489410-50-6- PubChem CID
- 1013019
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 682
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
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Compound notes
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