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15644-89-0 | 4-Hydroxy-8-methoxy-2-methylquinoline
CAS No: 15644-89-0 Catalog No: AG007Y5N MDL No:MFCD00272321
Product Description
Catalog Number:
AG007Y5N
Chemical Name:
4-Hydroxy-8-methoxy-2-methylquinoline
CAS Number:
15644-89-0
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD00272321
IUPAC Name:
8-methoxy-2-methyl-1H-quinolin-4-one
InChI:
InChI=1S/C11H11NO2/c1-7-6-9(13)8-4-3-5-10(14-2)11(8)12-7/h3-6H,1-2H3,(H,12,13)
InChI Key:
DJYYBMQABYVSBR-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc(C)cc2O
NSC Number:
208722
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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