200,000+ products from a single source!
sales@angenechem.com
70121-94-7 | 4H-1-Benzopyran-4-one, 7-hydroxy-3-(2-quinolinyl)-
CAS No: 70121-94-7 Catalog No: AG005L5H MDL No:
Product Description
Catalog Number:
AG005L5H
Chemical Name:
4H-1-Benzopyran-4-one, 7-hydroxy-3-(2-quinolinyl)-
CAS Number:
70121-94-7
Molecular Formula:
C18H11NO3
Molecular Weight:
289.2848
IUPAC Name:
7-hydroxy-3-quinolin-2-ylchromen-4-one
InChI:
InChI=1S/C18H11NO3/c20-12-6-7-13-17(9-12)22-10-14(18(13)21)16-8-5-11-3-1-2-4-15(11)19-16/h1-10,20H
InChI Key:
ZHLCBXGOOIALKS-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)occ(c2=O)c1ccc2c(n1)cccc2
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.074g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.29g/mol
Monoisotopic Mass:
289.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.