Basic information
- Standard SMILES
N#Cc1cnn2c(-c3cc(Cl)ccc3Cl)ccnc12- InChIKey
DZBUTDGWNQMPKR-UHFFFAOYSA-N- Molecular formula
- C13H6Cl2N4
- Average molar mass
- 289.12 g/mol
- Monoisotopic mass
- 287.9969516
Names & identifiers
- Preferred name
- 7-(2,5-Dichlorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
- IUPAC
- 7-(2,5-dichlorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Names & synonyms
SCHEMBL9468475DZBUTDGWNQMPKR-UHFFFAOYSA-N7-(2,5-dichlorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Database identifiers
- PubChem CID
- 14501874
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 382
Related reactions
1 records
Compound notes
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