Home Amines 1009734-33-1
1009734-33-1,MFCD22666183
Catalog No.:AA0003A0
1009734-33-1 | 5-tert-Butoxyquinazoline-2,4-diamine
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1mg
≥98%
1 week  
$209.00   $146.00
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5mg
≥98%
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$680.00   $476.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0003A0
Chemical Name:
5-tert-Butoxyquinazoline-2,4-diamine
CAS Number:
1009734-33-1
Molecular Formula:
C12H16N4O
Molecular Weight:
232.2816
MDL Number:
MFCD22666183
IUPAC Name:
5-[(2-methylpropan-2-yl)oxy]quinazoline-2,4-diamine
InChI:
InChI=1S/C12H16N4O/c1-12(2,3)17-8-6-4-5-7-9(8)10(13)16-11(14)15-7/h4-6H,1-3H3,(H4,13,14,15,16)
InChI Key:
JQHKDYFLRJIBLX-UHFFFAOYSA-N
SMILES:
Nc1nc(N)c2c(n1)cccc2OC(C)(C)C
Properties
Computed Properties
 
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.132g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.287g/mol
Monoisotopic Mass:
232.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
5-tert-butoxyquinazoline-2,4-diamine 
1009734-33-1 
BCP13575 
BDBM50385959 
MFCD22666183 
ZINC84729336 
AKOS027253254 
HZ-1327 
AK202965 
5-[(2-methylpropan-2-yl)oxy]quinazoline-2,4-diamine 
5-tert-butoxyquinazoline-2,4-diaMine 
5-(tert-Butoxy)quinazoline-2,4-diamine 
HZ-1157 
CHEMBL2042321 
2,4-Quinazolinediamine, 5-(1,1-dimethylethoxy)- 
DHFR-inhibitor 
SCHEMBL15283857 
AOB5039 
Literature

Title: Discovery and optimization of 2,4-diaminoquinazoline derivatives as a new class of potent dengue virus inhibitors.

Journal: Journal of medicinal chemistry 20120412

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