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4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline

4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline structure

CAS No:
38901-83-6
Formula:
C17H19N4OS+
Chemical Name:
4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline
Synonyms:
basic blue 54;BB54 dye;C.I. 11052;C.I. basic blue 54;C.I. basic blue 54 acetate;C.I. basic blue 54 chloride;C.I. basic blue 54 methyl sulfate;C.I. basic blue 54 phosphate;C.I. basic blue 54 sulfate;Basic Blue 54;C.I. Basic Blue 54;CHEMBL1944960;38901-83-6;C17H19N4OS;C.I. 11052;SCHEMBL6911483;SCHEMBL13324480;DTXSID50192146;ZINC5159499;BDBM50363721;4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline;T286;2-[[4-(Dimethylamino)phenyl]azo]-6-methoxy-3-methylbenzothiazol-3-ium;Benzothiazolium, 2-((4-(dimethylamino)phenyl)azo)-6-methoxy-3-methyl-

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4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline Basic Attributes

Molecular Weight：

327.4 g/mol

Exact Mass：

327.12795742 g/mol

DSSTox ID：

DTXSID50192146

Characteristics

PSA：

69.3 Å²

Drug Information

MeSH Entry Terms：

basic blue 54

Computed Properties

Molecular Weight:327.4
XLogP3:4.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:327.12795742
Monoisotopic Mass:327.12795742
Topological Polar Surface Area:69.3
Heavy Atom Count:23
Formal Charge:1
Complexity:411
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline

Basic Attributes
Characteristics
Drug Information
Computed Properties

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