Basic information
- CAS
1160271-51-1- Standard SMILES
COc1ccc(OC)c(C2=NN(C(C)=O)C(c3cccc(O)c3)C2)c1- InChIKey
WZGUFBCOIOCQTM-UHFFFAOYSA-N- Molecular formula
- C19H20N2O4
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.14230712
Names & identifiers
- Preferred name
- 1-[3-(2,5-dimethoxyphenyl)-5-(3-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
- IUPAC
- 1-[5-(2,5-dimethoxyphenyl)-3-(3-hydroxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone
Names & synonyms
1-[3-(2,5-dimethoxyphenyl)-5-(3-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanoneDTXSID601129803STK506891AKOS002337125AKOS0163351591160271-51-1ST510633351-acetyl-3-(2,5-dimethoxyphenyl)-5-(3-hydroxyphenyl)-2-pyrazoline1-[3-(2,5-Dimethoxyphenyl)-4,5-dihydro-5-(3-hydroxyphenyl)-1H-pyrazol-1-yl]ethanone1-[3-(2,5-Dimethoxyphenyl)-5-(3-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Database identifiers
- CAS
1160271-51-1- PubChem CID
- 43840596
- DTXSID
DTXSID601129803
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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