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24613-96-5 | Quinoline, 2-(2-benzoxazolyl)-
CAS No: 24613-96-5 Catalog No: AG002ORI MDL No:
Product Description
Catalog Number:
AG002ORI
Chemical Name:
Quinoline, 2-(2-benzoxazolyl)-
CAS Number:
24613-96-5
Molecular Formula:
C16H10N2O
Molecular Weight:
246.2634
IUPAC Name:
2-quinolin-2-yl-1,3-benzoxazole
InChI:
InChI=1S/C16H10N2O/c1-2-6-12-11(5-1)9-10-14(17-12)16-18-13-7-3-4-8-15(13)19-16/h1-10H
InChI Key:
LEYACHSFIUEDPZ-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)nc(cc2)c1nc2c(o1)cccc2
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.269g/mol
Monoisotopic Mass:
246.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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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