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1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone

1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone structure

CAS No:
1427739-75-0
Formula:
C21H22N4O5
Chemical Name:
1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
Synonyms:
ZINC2640440;AKOS033426714;MCULE-1610103387;Z15584846;1-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethan-1-one;1427739-75-0

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1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone Basic Attributes

Molecular Weight：

410.4 g/mol

Exact Mass：

410.15901982 g/mol

Characteristics

PSA：

104 Å²

Computed Properties

Molecular Weight:410.4
XLogP3:3.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:410.15901982
Monoisotopic Mass:410.15901982
Topological Polar Surface Area:104
Heavy Atom Count:30
Complexity:658
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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