 Home > Encyclopedia > 2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone

2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone

2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone structure

CAS No:
453526-46-0
Formula:
C22H15F2N5O3S2
Chemical Name:
2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone
Synonyms:
ZINC3240846;AKOS033666554;MCULE-5745192037;Z19229763;2-[(4-{4-[(difluoromethyl)sulfanyl]phenyl}-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-nitrophenyl)ethan-1-one;453526-46-0

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2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone Basic Attributes

Molecular Weight：

499.5 g/mol

Exact Mass：

499.05843803 g/mol

Characteristics

PSA：

157 Å²

Computed Properties

Molecular Weight:499.5
XLogP3:5.2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:499.05843803
Monoisotopic Mass:499.05843803
Topological Polar Surface Area:157
Heavy Atom Count:34
Complexity:688
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-[4-(difluoromethylsulfanyl)phenyl]-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-nitrophenyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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