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Home> Hot Product Listed 4   > 4-(3-furan-2-yl-1-phenyl-1h-pyrazol-4-yl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid di...
25063-76-7 structure

4-(3-furan-2-yl-1-phenyl-1h-pyrazol-4-yl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid diallyl ester

Iupac Name:2,2-dimethyl-5-[(quinolin-8-ylamino)methylidene]-1,3-dioxane-4,6-dione
CAS No.:25063-76-7
Molecular Weight:298.298
Molecular Formula:C18H19NOS (isomer)
Names and Identifiers
Synonyms

3,5-bis(prop-2-en-1-yl) 4-[3-(furan-2-yl)-1-phenyl-1h-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate 3,5-bis(prop-2-en-1-yl) 4-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate AC1MVTOY AC1Q2DH9 AKOS001666978 bis(prop-2-enyl) 4-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CHEMBL1602936 CHEMDIV1_010143 diallyl 4-[3-(2-furyl)-1-phenyl-1h-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate diprop-2-en-1-yl 4-[3-(furan-2-yl)-1-phenyl-1h-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate HMS2612M06 HMS615N01 MCULE-5588411902 MLS000595227 MLS002581313 MOLPORT-000-715-522 smr000149750 sr-01000493122 SR-01000493122-1 STK820998 STOCK1S-69722 ZINC100714070

Inchi
InChI=1S/C16H14N2O4/c1-16(2)21-14(19)11(15(20)22-16)9-18-12-7-3-5-10-6-4-8-17-13(10)12/h3-9,18H,1-2H3
InChkey
UEZIKDYLTILMQY-UHFFFAOYSA-N
Canonical Smiles
CC1(OC(=O)C(=CNC2=CC=CC3=C2N=CC=C3)C(=O)O1)C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:298.298g/mol
  • Molecular Formula:C18H19NOS
  • Compound Is Canonicalized:True
  • Exact Mass:298.095
  • Monoisotopic Mass:298.095
  • Complexity:478
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:6
  • Heavy Atom Count:22
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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