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2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one

2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one structure

CAS No:
91063-28-4
Formula:
C11H9ClN2OS
Chemical Name:
2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one
Synonyms:
NSC48405;91063-28-4;NSC-48405;2-[(4-chlorobenzyl)sulfanyl]pyrimidin-4-ol;Maybridge4_002205;NCIStruc1_000517;NCIStruc2_000463;CHEMBL1741445;DTXSID60286949;HMS1527E05;HMS1586H07;NCI48405;CCG-37468;NCGC00013596;STK357412;ZINC17946267;AKOS001656015;AKOS004112162;MCULE-1533133330;2-((4-chlorobenzyl)thio)-4-pyrimidinol;NCGC00013596-02;NCGC00013596-03;NCGC00096709-01;NCGC00096709-02;NCI60_004151;ST4141846;2-[(4-chlorobenzyl)sulfanyl]-4-pyrimidinol;2-[(4-chlorophenyl)methylthio]pyrimidin-4-ol;2-(4-chloro-benzylsulfanyl)-3H-pyrimidin-4-one;AB00115454-01;SR-01000471154;SR-01000471154-1;BRD-K20546584-001-01-5

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2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one Basic Attributes

Molecular Weight：

252.72 g/mol

Exact Mass：

252.0124118 g/mol

NSC Number：

48405

DSSTox ID：

DTXSID60286949

Characteristics

PSA：

66.8 Å²

Computed Properties

Molecular Weight:252.72
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:252.0124118
Monoisotopic Mass:252.0124118
Topological Polar Surface Area:66.8
Heavy Atom Count:16
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one

Basic Attributes
Characteristics
Computed Properties

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