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2-(1H-benzimidazol-2-yl)-4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-hydroxybut-2-enenitrile

2-(1H-benzimidazol-2-yl)-4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-hydroxybut-2-enenitrile structure

CAS No:
757228-46-9
Formula:
C19H20N6OS2
Chemical Name:
2-(1H-benzimidazol-2-yl)-4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-hydroxybut-2-enenitrile
Synonyms:
ZINC2619425;Z20177438;4-{[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl}-2-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-3-oxobutanenitrile;757228-46-9

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2-(1H-benzimidazol-2-yl)-4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-hydroxybut-2-enenitrile Basic Attributes

Molecular Weight：

412.5 g/mol

Exact Mass：

412.11400163 g/mol

Characteristics

PSA：

164 Å²

Computed Properties

Molecular Weight:412.5
XLogP3:4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:412.11400163
Monoisotopic Mass:412.11400163
Topological Polar Surface Area:164
Heavy Atom Count:28
Complexity:617
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)-4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-hydroxybut-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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