4-[(4-Methoxyphenyl)diazenyl]-3,5-diphenylpyrazole-1-carbothioamide
Basic information
- CAS
24743-51-9- Standard SMILES
COc1ccc(N=Nc2c(-c3ccccc3)nn(C(N)=S)c2-c2ccccc2)cc1- InChIKey
FFNFNYLTWGACFJ-UHFFFAOYSA-N- Molecular formula
- C23H19N5OS
- Average molar mass
- 413.5 g/mol
- Monoisotopic mass
- 413.13103142
Names & identifiers
- Preferred name
- 4-[(4-Methoxyphenyl)diazenyl]-3,5-diphenylpyrazole-1-carbothioamide
- IUPAC
- 4-[(4-methoxyphenyl)diazenyl]-3,5-diphenylpyrazole-1-carbothioamide
Names & synonyms
NSC12864724743-51-9DTXSID10402298NSC-1286474-[(E)-(4-Methoxyphenyl)diazenyl]-3,5-diphenyl-1H-pyrazole-1-carbothioamide
Database identifiers
- CAS
24743-51-9- PubChem CID
- 4354891
- DTXSID
DTXSID10402298
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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