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Home Aminos 6-amino-3-methyl-1-propyl-uraci

6-amino-3-methyl-1-propyl-uraci

CAS No.:
53681-48-4
Catalog Number:
AG00DH3H
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
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Product Description
Catalog Number:
AG00DH3H
Chemical Name:
6-amino-3-methyl-1-propyl-uraci
CAS Number:
53681-48-4
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
MDL Number:
MFCD01677162
IUPAC Name:
6-amino-3-methyl-1-propylpyrimidine-2,4-dione
InChI:
InChI=1S/C8H13N3O2/c1-3-4-11-6(9)5-7(12)10(2)8(11)13/h5H,3-4,9H2,1-2H3
InChI Key:
WPDWDWXAXRTNAQ-UHFFFAOYSA-N
SMILES:
Cn1c(=O)n(CCC)c(cc1=O)N
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.101g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.211g/mol
Monoisotopic Mass:
183.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
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