 Home > Encyclopedia > 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile

2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile

2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile structure

CAS No:
764697-16-7
Formula:
C25H16FN5OS3
Chemical Name:
2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile
Synonyms:
Z55547780;2-[4-(4-fluorophenyl)-2,3-dihydro-1,3-thiazol-2-ylidene]-3-oxo-4-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butanenitrile;764697-16-7

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2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile Basic Attributes

Molecular Weight：

517.6 g/mol

Exact Mass：

517.05010183 g/mol

Characteristics

PSA：

169 Å²

Computed Properties

Molecular Weight:517.6
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:517.05010183
Monoisotopic Mass:517.05010183
Topological Polar Surface Area:169
Heavy Atom Count:35
Complexity:795
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-hydroxy-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]but-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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