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1-methyl-N-(6-methylsulfanylpurin-9-yl)-5-oxopyrrolidine-3-carboxamide

1-methyl-N-(6-methylsulfanylpurin-9-yl)-5-oxopyrrolidine-3-carboxamide structure

CAS No:
57464-52-5
Formula:
C12H14N6O2S
Chemical Name:
1-methyl-N-(6-methylsulfanylpurin-9-yl)-5-oxopyrrolidine-3-carboxamide
Synonyms:
57464-52-5;NSC171567;DTXSID90305738;NSC-171567;1-Methyl-N-[6-(methylsulfanyl)-9H-purin-9-yl]-5-oxopyrrolidine-3-carboxamide

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1-methyl-N-(6-methylsulfanylpurin-9-yl)-5-oxopyrrolidine-3-carboxamide Basic Attributes

Molecular Weight：

306.35 g/mol

Exact Mass：

306.08989488 g/mol

NSC Number：

171567

DSSTox ID：

DTXSID90305738

Characteristics

PSA：

118 Å²

Computed Properties

Molecular Weight:306.35
XLogP3:-0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:306.08989488
Monoisotopic Mass:306.08989488
Topological Polar Surface Area:118
Heavy Atom Count:21
Complexity:436
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-methyl-N-(6-methylsulfanylpurin-9-yl)-5-oxopyrrolidine-3-carboxamide

Basic Attributes
Characteristics
Computed Properties

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