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14151-19-0 | 5,8-Quinolinedione, 7-amino-6-methoxy-
CAS No: 14151-19-0 Catalog No: AG001GJR MDL No:
Product Description
Catalog Number:
AG001GJR
Chemical Name:
5,8-Quinolinedione, 7-amino-6-methoxy-
CAS Number:
14151-19-0
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
IUPAC Name:
7-amino-6-methoxyquinoline-5,8-dione
InChI:
InChI=1S/C10H8N2O3/c1-15-10-6(11)9(14)7-5(8(10)13)3-2-4-12-7/h2-4H,11H2,1H3
InChI Key:
NLVITWPVYZJFCX-UHFFFAOYSA-N
SMILES:
COC1=C(N)C(=O)c2c(C1=O)cccn2
UNII:
H7I2CX2K9C
NSC Number:
76890
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Insights into the mechanism of streptonigrin-induced protein arginine deiminase inactivation. | Bioorganic & medicinal chemistry 20140215 |
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