 Home > Encyclopedia > 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
851617-93-1
Formula:
C22H25N5O3S
Chemical Name:
1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC3353421;AKOS002460211;MCULE-6774216821;Z17164534;1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)-1H-pyrrol-3-yl]-2-{[5-(furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;851617-93-1

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1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

439.5 g/mol

Exact Mass：

439.16781085 g/mol

Characteristics

PSA：

117 Å²

Computed Properties

Molecular Weight:439.5
XLogP3:4.1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:439.16781085
Monoisotopic Mass:439.16781085
Topological Polar Surface Area:117
Heavy Atom Count:31
Complexity:626
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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