AC1L7A76 structure

AC1L7A76

2-[[(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]isoindole-1,3-dione

Also Known As: 2-[[(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)amino]methy|2-[({2-[(Prop-2-en-1-yl)sulfanyl]-1,3-benzothiazol-6-yl}amino)methyl]-1H-isoindole-1,3(2H)-dione|2-[[(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]isoindole-1,3-dione

CAS: 71085-73-9
Molecular Formula C19H15N3O2S2
Molecular Weight 381.06058 g/mol
LogP 4.6
Topological Polar Surface Area 116.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 381.06058
Monoisotopic Mass 381.06058
Heavy Atoms 26
Complexity 549.0

Chemical Identifiers

CAS Number 71085-73-9
SMILES C=CCSC1=NC2=C(S1)C=C(C=C2)NCN3C(=O)C4=CC=CC=C4C3=O
InChIKey UKTMBJVHCXBJPR-UHFFFAOYSA-N

Product Overview

AC1L7A76 (CAS 71085-73-9), with molecular formula C19H15N3O2S2 and molecular weight 381.06058 g/mol. IUPAC: 2-[[(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)amino]methyl]isoindole-1,3-dione.

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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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