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2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]acetonitrile

2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]acetonitrile structure

CAS No:
851206-82-1
Formula:
C19H17N3O2S
Chemical Name:
2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]acetonitrile
Synonyms:
HMS1730K08;ZINC3346062;AKOS034401043;MCULE-3578777576;AB00730299-01;Z48848934;2-(4-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-1,3-thiazol-2-yl)acetonitrile;851206-82-1

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2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]acetonitrile Basic Attributes

Molecular Weight：

351.4 g/mol

Exact Mass：

351.10414797 g/mol

Characteristics

PSA：

88.3 Å²

Computed Properties

Molecular Weight:351.4
XLogP3:3.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:351.10414797
Monoisotopic Mass:351.10414797
Topological Polar Surface Area:88.3
Heavy Atom Count:25
Complexity:524
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]acetonitrile

Basic Attributes
Characteristics
Computed Properties

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