 Home > Encyclopedia > 2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile

2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile

2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile structure

CAS No:
634593-33-2
Formula:
C26H30N2OS
Chemical Name:
2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile
Synonyms:
ZINC2249028;STK612564;AKOS003681529;MCULE-5942358534;2-{[(2-hydroxynaphthalen-1-yl)methyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile;634593-33-2

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2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile Basic Attributes

Molecular Weight：

418.6 g/mol

Exact Mass：

418.20788476 g/mol

Characteristics

PSA：

84.3 Å²

Computed Properties

Molecular Weight:418.6
XLogP3:9.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:418.20788476
Monoisotopic Mass:418.20788476
Topological Polar Surface Area:84.3
Heavy Atom Count:30
Complexity:575
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(2-hydroxynaphthalen-1-yl)methylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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