Basic information
- Standard SMILES
Clc1ccc(-c2cc(Cl)n3nccc3n2)cc1- InChIKey
VYBFCBRYYWDQEF-UHFFFAOYSA-N- Molecular formula
- C12H7Cl2N3
- Average molar mass
- 264.11 g/mol
Names & identifiers
- Preferred name
- 7-Chloro-5-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine
- IUPAC
- 7-chloro-5-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine
Names & synonyms
7-chloro-5-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine673475-71-3SCHEMBL312516VYBFCBRYYWDQEF-UHFFFAOYSA-NMFCD09756311SY520658DB-1566237-chloro-5-(4-chloro-phenyl)-pyrazolo[1,5-a]pyrimidine
Database identifiers
- PubChem CID
- 21035702
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 268
Related reactions
28 records
Compound notes
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