3-([1,1'-Biphenyl]-4-yl)-1-methyl-5-phenyl-4-propoxy-1H-pyrazole
Basic information
- CAS
60627-78-3- Standard SMILES
CCCOc1c(-c2ccc(-c3ccccc3)cc2)nn(C)c1-c1ccccc1- InChIKey
KNHBGSAAXBEGME-UHFFFAOYSA-N- Molecular formula
- C25H24N2O
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.18886339
Names & identifiers
- Preferred name
- 3-([1,1'-Biphenyl]-4-yl)-1-methyl-5-phenyl-4-propoxy-1H-pyrazole
- IUPAC
- 1-methyl-5-phenyl-3-(4-phenylphenyl)-4-propoxypyrazole
Names & synonyms
60627-78-33-([1,1'-Biphenyl]-4-yl)-1-methyl-5-phenyl-4-propoxy-1H-pyrazoleDTXSID20821799
Database identifiers
- CAS
60627-78-3- PubChem CID
- 71400528
- DTXSID
DTXSID20821799
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 449
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Compound notes
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