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2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile structure

CAS No:
332045-25-7
Formula:
C35H34N2O2S
Chemical Name:
2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Synonyms:
332045-25-7;4-(4-(benzyloxy)phenyl)-2-((2-(4-butylphenyl)-2-oxoethyl)thio)-5,6,7,8-tetrahydroquinoline-3-carbonitrile;4-[4-(benzyloxy)phenyl]-2-{[2-(4-butylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile;ZINC8440494;AKOS001145952;MCULE-5002807316;2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile;AG-690/12888506;F0192-0551;4-[4-(benzyloxy)phenyl]-2-{[2-(4-butylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Basic Attributes

Molecular Weight：

546.7 g/mol

Exact Mass：

546.23409951 g/mol

Characteristics

PSA：

88.3 Å²

Computed Properties

Molecular Weight:546.7
XLogP3:9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:546.23409951
Monoisotopic Mass:546.23409951
Topological Polar Surface Area:88.3
Heavy Atom Count:40
Complexity:819
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-(4-(benzyloxy)phenyl)-2-((2-(4-butylphenyl)-2-oxoethyl)thio)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

CAS No.: 332045-25-7

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Guide of 2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

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