AC1MSXJB structure

AC1MSXJB

ethyl 3-(4-fluorophenyl)-4-oxo-5-(3-phenylpropanoylamino)thieno[3,4-d]pyridazine-1-carboxylate

Also Known As: AB00670410-01|F0641-0363|ethyl 3-(4-fluorophenyl)-4-oxo-5-(3-phenylpropanamido)-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate|ethyl 3-(4-fluorophenyl)-4-oxo-5-(3-phenylpropanamido)-3H,4H-thieno[3,4-d]pyridazine-1-carboxylate|ethyl 3-(4-fluorophenyl)-4-oxo-5-(3-phenylpropanoylamino)thieno[3,4-d]pyridazine-1-carboxylate

CAS: 851949-83-2
Molecular Formula C24H20FN3O4S
Molecular Weight 465.11584 g/mol
LogP 4.3343
Topological Polar Surface Area 90.29 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 465.11584
Monoisotopic Mass 465.11584
Heavy Atoms 33
Complexity 1364.4908

Chemical Identifiers

CAS Number 851949-83-2
SMILES CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CCC3=CC=CC=C3)C4=CC=C(C=C4)F

Product Overview

AC1MSXJB (CAS 851949-83-2), with molecular formula C24H20FN3O4S and molecular weight 465.11584 g/mol. IUPAC: ethyl 3-(4-fluorophenyl)-4-oxo-5-(3-phenylpropanoylamino)thieno[3,4-d]pyridazine-1-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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