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3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine;hydrochloride

3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine;hydrochloride structure

CAS No:
38357-93-6
Formula:
C22H26ClF3N4O
Chemical Name:
3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine;hydrochloride
Synonyms:
ITF 1016;38357-93-6;1H-Pyrazolo(3,4-b)pyridine, 3-(3-(hexahydro-1H-azepin-1-yl)propoxy)-1-(alpha,alpha,alpha-trifluoro-m-tolyl)-, monohydrochloride;DTXSID30191713;3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine hydrochloride;A827531;3-(3-(Azepan-1-yl)propoxy)-1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridine hydrochloride;3-[3-(1-azepanyl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine hydrochloride

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3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine;hydrochloride Basic Attributes

Molecular Weight：

454.9 g/mol

Exact Mass：

454.1747236 g/mol

DSSTox ID：

DTXSID30191713

Characteristics

PSA：

43.2 Å²

Computed Properties

Molecular Weight:454.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:454.1747236
Monoisotopic Mass:454.1747236
Topological Polar Surface Area:43.2
Heavy Atom Count:31
Complexity:527
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 3-[3-(azepan-1-yl)propoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine;hydrochloride

Basic Attributes
Characteristics
Computed Properties

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