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1028307-48-3,MFCD22573566
Catalog No.:AA003IP3
1028307-48-3 | 3-(2-((2-Methoxybenzyl)amino)ethyl)quinazoline-2,4(1h,3h)-dione
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1mg
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$130.00   $91.00
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5mg
≥95%
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$403.00   $282.00
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10mg
≥95%
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$674.00   $472.00
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Technical Information
Catalog Number:
AA003IP3
Chemical Name:
3-(2-((2-Methoxybenzyl)amino)ethyl)quinazoline-2,4(1h,3h)-dione
CAS Number:
1028307-48-3
Molecular Formula:
C18H19N3O3
Molecular Weight:
325.3618
MDL Number:
MFCD22573566
IUPAC Name:
3-[2-[(2-methoxyphenyl)methylamino]ethyl]-1H-quinazoline-2,4-dione
InChI:
InChI=1S/C18H19N3O3/c1-24-16-9-5-2-6-13(16)12-19-10-11-21-17(22)14-7-3-4-8-15(14)20-18(21)23/h2-9,19H,10-12H2,1H3,(H,20,23)
InChI Key:
NUAJBITWGGTZCM-UHFFFAOYSA-N
SMILES:
COc1ccccc1CNCCn1c(=O)[nH]c2c(c1=O)cccc2
UNII:
A31AED225O
Properties
Computed Properties
 
Complexity:
457  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.143g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
325.368g/mol
Monoisotopic Mass:
325.143g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
1028307-48-3 
3-(2-((2-Methoxybenzyl)amino)ethyl)quinazoline-2,4(1H,3H)-dione 
3-(2-(2-Methoxybenzylamino)ethyl)-1H-quinazoline-2,4-dione 
BCP06819 
0679AA 
MFCD22573566 
ZINC91296966 
AKOS016010681 
DS-5691 
AK119634 
AJ-129249 
AX8245050 
UNII-A31AED225O 
ST24041381 
J3.586.067C 
KS-00000108 
Methoxyphenyl)Methyl]aMino]ethyl]-2,4(1H,3H)quinazolinedione 
3-(2-(2-Methoxybenzylamino)ethyl)quinazoline-2(1H),4(3H)-dione 
3-(2-(2-methoxybenzylamino)ethyl)quinazoline-2,4(1H,3H)-dione 
3-{2-[(2-Methoxybenzyl)amino]ethyl}-2,4(1H,3H)-quinazolinedione 
3-(2-{[(2-Methoxyphenyl)methyl]amino}ethyl)quinazoline-2,4(1H,3H)-dione 
2,4(1H,3H)-Quinazolinedione, 3-(2-(((2-methoxyphenyl)methyl)amino)ethyl)- 
C18H19N3O3 
A31AED225O 
ACN-025718 
CID10041987 
3-[2-[[(2-Methoxyphenyl)methyl]amino]ethyl]-2,4(1H,3H)-quinazolinedione 
3-[2-[(2-methoxyphenyl)methylamino]ethyl]-1H-quinazoline-2,4-dione 
RH-34 
3-[2-[[(2-Methoxyphenyl)Methyl]aMino]ethyl]-2,4(1H,3 H)-quinazolinedione 
3-[2-[[(2-Methoxyphenyl)methyl]amino]ethyl]-2,4(1H,3H)quinazolinedione 
SCHEMBL10321390 
DTXSID80434687 
QCR-286 
Literature
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