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1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone

1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone structure

CAS No:
80087-23-6
Formula:
C17H22N4OS
Chemical Name:
1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone
Synonyms:
1-CPTTB;1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone;1-Cyclohexyl-4-((1-phenyl-1H-tetrazol-5-yl)thio)-1-butanone;SCHEMBL10968674;CTK5E7448;1-cyclohexyl-4-(1-phenyltetrazol-5-yl)sulfanylbutan-1-one;DTXSID50230072;1-Butanone, 1-cyclohexyl-4-((1-phenyl-1H-tetrazol-5-yl)thio)-

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1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone Basic Attributes

Molecular Weight：

330.45

Exact Mass：

330.151

DSSTox ID：

DTXSID50230072

Characteristics

PSA：

XLogP3：

4.2

Density：

1.28g/cm3

Boiling Point：

526.5ºC at 760 mmHg

Flash Point：

272.2ºC

Refractive Index：

1.659

Drug Information

MeSH Entry Terms：

1-CPTTB

Computed Properties

Molecular Weight:330.4
XLogP3:4.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:330.15143251
Monoisotopic Mass:330.15143251
Topological Polar Surface Area:86
Heavy Atom Count:23
Complexity:370
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone

Basic Attributes
Characteristics
Drug Information
Computed Properties

1-cyclohexyl-4-(1-phenyl-5-tetrazolyl)thio-1-butanone

SDS

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