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6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile

6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile structure

CAS No:
494792-26-6
Formula:
C23H25N5O2
Chemical Name:
6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile
Synonyms:
6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile;ZINC4631468;RSC005886;STK553554;AKOS003680748;MCULE-8697054020;AM-807/12740430;(8S,8aR)-6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile

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6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile Basic Attributes

Molecular Weight：

403.4769

Exact Mass：

403.201

Characteristics

PSA：

119

XLogP3：

1.9

Computed Properties

Molecular Weight:403.5
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:403.20082506
Monoisotopic Mass:403.20082506
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:851
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile

Basic Attributes
Characteristics
Computed Properties

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