Catalog No.:AA00JA7L

91129-84-9 | 4-Benzyl-5-methyl-4h-1,2,4-triazole-3-thiol

Name: Name:4-Benzyl-5-methyl-4h-1,2,4-triazole-3-thiol
Brand: AABLOCKS
SKU: AA00JA7L
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500mg

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>95%

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>95%

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10g

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Technical Information
Properties
Downstream Synthesis Route
Literature
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Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA00JA7L

Chemical Name:

4-Benzyl-5-methyl-4h-1,2,4-triazole-3-thiol

CAS Number:

91129-84-9

Molecular Formula:

C10H11N3S

Molecular Weight:

205.2794

MDL Number:

MFCD02612745

SMILES:

Cc1nnc(n1Cc1ccccc1)S

Properties

Computed Properties

Complexity:

256

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

1.5

Downstream Synthesis Route

26496-94-6

91129-84-9

C20H21N3O2S

[1]EuropeanJournalofMedicinalChemistry,2019,vol.163,p.597-609

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS