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604794-52-7

604794-52-7 | Acetamide, 2-[[2-(1-methylethyl)-4-quinazolinyl]thio]-N-(5-methyl-3-isoxazolyl)- (9CI)

CAS No: 604794-52-7 Catalog No: AG00EM7P MDL No:

Product Description

Catalog Number:
AG00EM7P
Chemical Name:
Acetamide, 2-[[2-(1-methylethyl)-4-quinazolinyl]thio]-N-(5-methyl-3-isoxazolyl)- (9CI)
CAS Number:
604794-52-7
IUPAC Name:
N-(5-methyl-1,2-oxazol-3-yl)-2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetamide
InChI:
InChI=1S/C17H18N4O2S/c1-10(2)16-18-13-7-5-4-6-12(13)17(20-16)24-9-15(22)19-14-8-11(3)23-21-14/h4-8,10H,9H2,1-3H3,(H,19,21,22)
InChI Key:
MGDZMXRQAZCEAN-UHFFFAOYSA-N

Properties

Complexity:
437  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.115g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
342.417g/mol
Monoisotopic Mass:
342.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

Literature

Title Journal
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

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