2-(4-Bromophenyl)-5-phenylpyrimidine
Basic information
- CAS
174720-39-9- Standard SMILES
Brc1ccc(-c2ncc(-c3ccccc3)cn2)cc1- InChIKey
UVFIXGWTZRLWMV-UHFFFAOYSA-N- Molecular formula
- C16H11BrN2
- Average molar mass
- 311.18 g/mol
- Monoisotopic mass
- 310.01056
Names & identifiers
- Preferred name
- 2-(4-Bromophenyl)-5-phenylpyrimidine
- IUPAC
- 2-(4-bromophenyl)-5-phenylpyrimidine
Names & synonyms
2-(4-bromophenyl)-5-phenylpyrimidine174720-39-9SMR000137433MLS000532494Cambridge id 5363983cid_768098CHEMBL1527857SCHEMBL15684061BDBM49447DTXSID601289253HMS2164N23HMS3315K03
Show more names
2-(4-bromophenyl)-5-phenyl-pyrimidine
Database identifiers
- CAS
174720-39-9- PubChem CID
- 768098
- DTXSID
DTXSID601289253- ChEMBL
CHEMBL1527857
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 262
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Compound notes
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