 Home > Encyclopedia > azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone

azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone

azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone structure

CAS No:
5678-77-3
Formula:
C18H16ClF3N4OS
Chemical Name:
azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone
Synonyms:
Azepan-1-yl(3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl)methanone;azepan-1-yl[3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone;SCHEMBL4204206;DTXSID90360029;ZINC753605;STK342668;AKOS000560783;MCULE-7086791275;azepan-1-yl-[3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone;ST50686781

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azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone Basic Attributes

Molecular Weight：

138.174

Exact Mass：

138.091

DSSTox ID：

DTXSID90360029

Characteristics

PSA：

76.8

XLogP3：

-1.1

Computed Properties

Molecular Weight:428.9
XLogP3:4.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:428.0685445
Monoisotopic Mass:428.0685445
Topological Polar Surface Area:78.7
Heavy Atom Count:28
Complexity:576
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: pyrophosphate formula; albendazole; h3bo3; borane; hexane msds; ischiorectal abscess

Guide of azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone

Basic Attributes
Characteristics
Computed Properties

azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone

SDS

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