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2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole

2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole structure

CAS No:
104065-98-7
Formula:
C17H21N3S2
Chemical Name:
2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole
Synonyms:
2-tert-butyl-6-isothiocyanato-5-(piperidin-1-yl)benzthiazole;CGI 16343;CGI-16343;Cgi 16343;104065-98-7;Cgi-16343;SCHEMBL9455583;DTXSID60146236;2-tert-Butyl-6-isothiocyanato-5-(piperidin-1-yl)benzthiazole;2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole;Benzothiazole, 2-(1,1-dimethylethyl)-6-isothiocyanato-5-(1-piperidinyl)-

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2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole Basic Attributes

Molecular Weight：

331.5 g/mol

Exact Mass：

331.11769003 g/mol

DSSTox ID：

DTXSID60146236

Characteristics

PSA：

88.8 Å²

Drug Information

MeSH Entry Terms：

2-tert-butyl-6-isothiocyanato-5-(piperidin-1-yl)benzthiazole

Computed Properties

Molecular Weight:331.5
XLogP3:6.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:331.11769003
Monoisotopic Mass:331.11769003
Topological Polar Surface Area:88.8
Heavy Atom Count:22
Complexity:436
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon tetrabromide; n2o4 lewis structure; ca hypochlorite; methyl acrylate; lead ii iodide; ethyl sulfate

Guide of 2-tert-butyl-6-isothiocyanato-5-piperidin-1-yl-1,3-benzothiazole

Basic Attributes
Characteristics
Drug Information
Computed Properties

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