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1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone

1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone structure

CAS No:
741733-47-1
Formula:
C22H18ClN3O3S2
Chemical Name:
1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone
Synonyms:
ZINC3309596;AKOS033661085;MCULE-7103395735;Z19125216;1-{1-[(2-chlorophenyl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one;741733-47-1

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1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone Basic Attributes

Molecular Weight：

472.0 g/mol

Exact Mass：

471.0478115 g/mol

Characteristics

PSA：

134 Å²

Computed Properties

Molecular Weight:472.0
XLogP3:6.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:471.0478115
Monoisotopic Mass:471.0478115
Topological Polar Surface Area:134
Heavy Atom Count:31
Complexity:666
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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