 Home > Encyclopedia > 2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile

2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile

2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile structure

CAS No:
729584-17-2
Formula:
C20H16N6O2S2
Chemical Name:
2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile
Synonyms:
ZINC3290940;Z19601817;2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-4-({5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-3-oxobutanenitrile;729584-17-2

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2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile Basic Attributes

Molecular Weight：

436.5 g/mol

Exact Mass：

436.07761612 g/mol

Characteristics

PSA：

173 Å²

Computed Properties

Molecular Weight:436.5
XLogP3:3.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:436.07761612
Monoisotopic Mass:436.07761612
Topological Polar Surface Area:173
Heavy Atom Count:30
Complexity:663
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]but-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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