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7150-03-0 | 2,4(1H,3H)-Pyrimidinedione,6-amino-5-bromo-3-methyl-
CAS No: 7150-03-0 Catalog No: AG005HOY MDL No:
Product Description
Catalog Number:
AG005HOY
Chemical Name:
2,4(1H,3H)-Pyrimidinedione,6-amino-5-bromo-3-methyl-
CAS Number:
7150-03-0
Molecular Formula:
C5H6BrN3O2
Molecular Weight:
220.0240
IUPAC Name:
6-amino-5-bromo-3-methyl-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C5H6BrN3O2/c1-9-4(10)2(6)3(7)8-5(9)11/h7H2,1H3,(H,8,11)
InChI Key:
MCWBXSSDBPTWRX-UHFFFAOYSA-N
SMILES:
Nc1[nH]c(=O)n(c(=O)c1Br)C
NSC Number:
72365
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.964g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.026g/mol
Monoisotopic Mass:
218.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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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