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2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]ethanone

2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]ethanone structure

CAS No:
783319-00-6
Formula:
C19H18F3N5OS
Chemical Name:
2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]ethanone
Synonyms:
MLS000334399;CHEMBL1303452;HMS2601G18;ZINC3364477;AKOS033931855;MCULE-1531645350;SMR000249157;Z25075169;2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-1-{2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}ethan-1-one;783319-00-6

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2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]ethanone Basic Attributes

Molecular Weight：

421.4 g/mol

Exact Mass：

421.11841587 g/mol

Characteristics

PSA：

125 Å²

Computed Properties

Molecular Weight:421.4
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:421.11841587
Monoisotopic Mass:421.11841587
Topological Polar Surface Area:125
Heavy Atom Count:29
Complexity:571
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]ethanone

Basic Attributes
Characteristics
Computed Properties

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