AC1LXWXY structure

AC1LXWXY

(3Z)-3-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one

Also Known As: (3Z)-3-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one|(3Z)-3-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one|(Z)-3-((1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-benzo[4,5]thiazolo[3,2-a]pyrimidin-2-one

CAS: 896813-64-2
Molecular Formula C24H19FN4O3S2
Molecular Weight 494.08826 g/mol
LogP 4.50591
Topological Polar Surface Area 95.59 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 494.08826
Monoisotopic Mass 494.08826
Heavy Atoms 34
Complexity 1568.1222

Chemical Identifiers

CAS Number 896813-64-2
SMILES CC1=CC(=C(N1C2=CC=C(C=C2)F)C)/C=C\3/C(=N)N4C5=C(C=C(C=C5)S(=O)(=O)C)SC4=NC3=O

Product Overview

AC1LXWXY (CAS 896813-64-2), with molecular formula C24H19FN4O3S2 and molecular weight 494.08826 g/mol. IUPAC: (3Z)-3-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-4-imino-8-methylsulfonylpyrimido[2,1-b][1,3]benzothiazol-2-one.

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