AC1OBGXC structure

AC1OBGXC

2-(1,3-benzothiazol-2-yl)-4-[(5-chloro-2-phenoxyphenyl)iminomethyl]-5-propyl-1H-pyrazol-3-one

Also Known As: (4E)-2-(1,3-benzothiazol-2-yl)-4-{[(5-chloro-2-phenoxyphenyl)amino]methylidene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one|(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(5-chloro-2-phenoxyanilino)methylidene]-5-propylpyrazol-3-one|(E)-1-(benzo[d]thiazol-2-yl)-4-(((5-chloro-2-phenoxyphenyl)amino)methylene)-3-propyl-1H-pyrazol-5(4H)-one|2-(1,3-benzothiazol-2-yl)-4-[(5-chloro-2-phenoxyanilino)methylidene]-5-propylpyrazol-3-one|2-benzothiazol-2-yl-4-[[(5-chloro-2-phenoxy-phenyl)amino]methylidene]-5-propyl-pyrazol-3-one

CAS: 444768-47-2
Molecular Formula C26H21ClN4O2S
Molecular Weight 488.10736 g/mol
LogP 6.9241
Topological Polar Surface Area 72.27 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 488.10736
Monoisotopic Mass 488.10736
Heavy Atoms 34
Complexity 1502.753

Chemical Identifiers

CAS Number 444768-47-2
SMILES CCCC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C=NC4=C(C=CC(=C4)Cl)OC5=CC=CC=C5

Product Overview

AC1OBGXC (CAS 444768-47-2), with molecular formula C26H21ClN4O2S and molecular weight 488.10736 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-[(5-chloro-2-phenoxyphenyl)iminomethyl]-5-propyl-1H-pyrazol-3-one.

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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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