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1-ethyl-3-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

1-ethyl-3-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile structure

CAS No:
371954-23-3
Formula:
C22H24N4OS
Chemical Name:
1-ethyl-3-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Synonyms:
ZINC2269994;STK529925;AKOS005462425;MCULE-8497032161;1-ethyl-3-{[3-(2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)propyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile;371954-23-3

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1-ethyl-3-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Basic Attributes

Molecular Weight：

392.5 g/mol

Exact Mass：

392.16708258 g/mol

Characteristics

PSA：

94.3 Å²

Computed Properties

Molecular Weight:392.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:392.16708258
Monoisotopic Mass:392.16708258
Topological Polar Surface Area:94.3
Heavy Atom Count:28
Complexity:605
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-ethyl-3-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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