Name: Name:2H-Imidazole-2-thione, 1-(4-chlorophenyl)-1,3-dihydro-
Brand: Angene
SKU: AG001ZQX
Rating: 90 (10 reviews)

2H-Imidazole-2-thione, 1-(4-chlorophenyl)-1,3-dihydro-

CAS No.:

17452-12-9

Catalog Number:

AG001ZQX

Molecular Formula:

C9H7ClN2S

Molecular Weight:

210.6833

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Product Description

Catalog Number:

AG001ZQX

Chemical Name:

2H-Imidazole-2-thione, 1-(4-chlorophenyl)-1,3-dihydro-

CAS Number:

17452-12-9

Molecular Formula:

C9H7ClN2S

Molecular Weight:

210.6833

MDL Number:

MFCD00665199

IUPAC Name:

3-(4-chlorophenyl)-1H-imidazole-2-thione

InChI:

InChI=1S/C9H7ClN2S/c10-7-1-3-8(4-2-7)12-6-5-11-9(12)13/h1-6H,(H,11,13)

InChI Key:

QJWMVYCYPCPSKK-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)n1cc[nH]c1=S

Properties

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.002g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.679g/mol

Monoisotopic Mass:

210.002g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties