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131598-61-3 | 2,4(1H,3H)-Pyrimidinedione, 6-amino-5-bromo-1-ethyl-
CAS No: 131598-61-3 Catalog No: AG000ZGG MDL No:MFCD05253023
Product Description
Catalog Number:
AG000ZGG
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 6-amino-5-bromo-1-ethyl-
CAS Number:
131598-61-3
Molecular Formula:
C6H8BrN3O2
Molecular Weight:
234.0506
MDL Number:
MFCD05253023
IUPAC Name:
6-amino-5-bromo-1-ethylpyrimidine-2,4-dione
InChI:
InChI=1S/C6H8BrN3O2/c1-2-10-4(8)3(7)5(11)9-6(10)12/h2,8H2,1H3,(H,9,11,12)
InChI Key:
DVZWWTRLSAYQKE-UHFFFAOYSA-N
SMILES:
CCn1c(N)c(Br)c(=O)[nH]c1=O
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.98g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.053g/mol
Monoisotopic Mass:
232.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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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