Basic information
- CAS
477713-40-9- Standard SMILES
COc1ccc(C(=O)n2ccc(-c3ccccc3OCc3ccc(Cl)cc3)n2)cc1- InChIKey
PLTPMZNHUAUZBF-UHFFFAOYSA-N- Molecular formula
- C24H19ClN2O3
- Average molar mass
- 418.9 g/mol
- Monoisotopic mass
- 418.1084202
Names & identifiers
- Preferred name
- [3-[2-[(4-Chlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methoxyphenyl)methanone
- IUPAC
- [3-[2-[(4-chlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methoxyphenyl)methanone
- English name
- (3-(2-[(4-CHLOROBENZYL)OXY]PHENYL)-1H-PYRAZOL-1-YL)(4-METHOXYPHENYL)METHANONE
- Molecular formula
- C24H19ClN2O3
- Molecular weight
- 418.87
Names & synonyms
477713-40-9(3-{2-[(4-chlorobenzyl)oxy]phenyl}-1H-pyrazol-1-yl)(4-methoxyphenyl)methanone[3-[2-[(4-chlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methoxyphenyl)methanone3-{2-[(4-chlorophenyl)methoxy]phenyl}-1-(4-methoxybenzoyl)-1H-pyrazole(3-(2-((4-Chlorobenzyl)oxy)phenyl)-1H-pyrazol-1-yl)(4-methoxyphenyl)methanoneOprea1_474129AKOS0050938355R-0245(3-(2-[(4-CHLOROBENZYL)OXY]PHENYL)-1H-PYRAZOL-1-YL)(4-METHOXYPHENYL)METHANONEMethanone, [3-[2-[(4-chlorophenyl)methoxy]phenyl]-1H-pyrazol-1-yl](4-methoxyphenyl)-
Database identifiers
- CAS
477713-40-9- PubChem CID
- 3680791
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 547
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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