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2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile

2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile structure

CAS No:
79220-60-3
Formula:
C13H10ClN5S
Chemical Name:
2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile
Synonyms:
MLS003171422;79220-60-3;NSC379538;Maybridge4_000037;CHEMBL2131713;DTXSID00321666;HMS1521B15;CCG-244031;MCULE-4202203597;NSC-379538;IDI1_030619;2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile;SMR001875315;BRD-A60523234-001-01-1

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2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile Basic Attributes

Molecular Weight：

303.77 g/mol

Exact Mass：

303.0345442 g/mol

NSC Number：

379538

DSSTox ID：

DTXSID00321666

Characteristics

PSA：

89.1 Å²

Computed Properties

Molecular Weight:303.77
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:303.0345442
Monoisotopic Mass:303.0345442
Topological Polar Surface Area:89.1
Heavy Atom Count:20
Complexity:538
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-chlorophenyl)-5-methylsulfanyl-2,3-dihydro-[1,2,4]triazolo[1,5-c]pyrimidine-8-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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