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Home > Other Building Blocks > 128937-74-6
128937-74-6 | 1,4-Naphthalenedione, 2-methoxy-3-(4-morpholinyl)-
CAS No: 128937-74-6 Catalog No: AG000YK0 MDL No:
Product Description
Catalog Number:
AG000YK0
Chemical Name:
1,4-Naphthalenedione, 2-methoxy-3-(4-morpholinyl)-
CAS Number:
128937-74-6
Molecular Formula:
C15H15NO4
Molecular Weight:
273.2839
IUPAC Name:
2-methoxy-3-morpholin-4-ylnaphthalene-1,4-dione
InChI:
InChI=1S/C15H15NO4/c1-19-15-12(16-6-8-20-9-7-16)13(17)10-4-2-3-5-11(10)14(15)18/h2-5H,6-9H2,1H3
InChI Key:
WUTXIXPBNDXIEL-UHFFFAOYSA-N
SMILES:
COC1=C(N2CCOCC2)C(=O)c2c(C1=O)cccc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.1g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.288g/mol
Monoisotopic Mass:
273.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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 |
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