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62530-07-8

62530-07-8 | Thiourea, 1H-benzimidazol-2-yl- (9CI)

CAS No: 62530-07-8 Catalog No: AG00EI3O MDL No:

Product Description

Catalog Number:
AG00EI3O
Chemical Name:
Thiourea, 1H-benzimidazol-2-yl- (9CI)
CAS Number:
62530-07-8
IUPAC Name:
1H-benzimidazol-2-ylthiourea
InChI:
InChI=1S/C8H8N4S/c9-7(13)12-8-10-5-3-1-2-4-6(5)11-8/h1-4H,(H4,9,10,11,12,13)
InChI Key:
SLMDQOMBRAMXSN-UHFFFAOYSA-N

Properties

Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.047g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
192.24g/mol
Monoisotopic Mass:
192.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
98.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Literature

Title Journal
Subtype-selectivity of metal-dependent methionine aminopeptidase inhibitors. Bioorganic & medicinal chemistry letters 20100715
Metal-mediated inhibition of Escherichia coli methionine aminopeptidase: structure-activity relationships and development of a novel scoring function for metal-ligand interactions. Journal of medicinal chemistry 20060126

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