AC1M021U structure

AC1M021U

(6Z)-6-[[4-[3-(2,4-dimethylphenoxy)propoxy]-3-methoxyphenyl]methylidene]-5-imino-2-thiophen-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Also Known As: (6Z)-6-[[4-[3-(2,4-dimethylphenoxy)propoxy]-3-methoxyphenyl]methylidene]-5-imino-2-thiophen-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6Z)-6-{4-[3-(2,4-dimethylphenoxy)propoxy]-3-methoxybenzylidene}-5-imino-2-(thiophen-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-6-(4-(3-(2,4-dimethylphenoxy)propoxy)-3-methoxybenzylidene)-5-imino-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one

CAS: 577697-11-1
Molecular Formula C28H26N4O4S2
Molecular Weight 546.1395 g/mol
LogP 5.88891
Topological Polar Surface Area 96.57 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 9
Exact Mass 546.1395
Monoisotopic Mass 546.1395
Heavy Atoms 38
Complexity 1477.9641

Chemical Identifiers

CAS Number 577697-11-1
SMILES CC1=CC(=C(C=C1)OCCCOC2=C(C=C(C=C2)/C=C\3/C(=N)N4C(=NC3=O)SC(=N4)C5=CC=CS5)OC)C

Product Overview

AC1M021U (CAS 577697-11-1), with molecular formula C28H26N4O4S2 and molecular weight 546.1395 g/mol. IUPAC: (6Z)-6-[[4-[3-(2,4-dimethylphenoxy)propoxy]-3-methoxyphenyl]methylidene]-5-imino-2-thiophen-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.

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