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6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile

6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile structure

CAS No:
494792-34-6
Formula:
C25H23N5O
Chemical Name:
6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile
Synonyms:
6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile;ZINC4631490;RSC005908;STK544238;AKOS003681129;MCULE-5397231707;AM-807/13104036;(8S,8aR)-6-amino-2-ethyl-8-(4-methoxynaphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile;494792-34-6

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6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile Basic Attributes

Molecular Weight：

409.48302

Exact Mass：

409.19

Characteristics

PSA：

110

XLogP3：

2.7

Computed Properties

Molecular Weight:409.5
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:409.19026037
Monoisotopic Mass:409.19026037
Topological Polar Surface Area:110
Heavy Atom Count:31
Complexity:921
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-amino-2-ethyl-8-(4-methoxy-1-naphthyl)-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile

Basic Attributes
Characteristics
Computed Properties

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