200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 160031-68-5
160031-68-5 | Ethanone, 1-[5-hydroxy-3-methyl-1-(2-quinolinyl)-1H-pyrazol-4-yl]-
CAS No: 160031-68-5 Catalog No: AG001RMA MDL No:
Product Description
Catalog Number:
AG001RMA
Chemical Name:
Ethanone, 1-[5-hydroxy-3-methyl-1-(2-quinolinyl)-1H-pyrazol-4-yl]-
CAS Number:
160031-68-5
Molecular Formula:
C15H13N3O2
Molecular Weight:
267.2826
IUPAC Name:
4-acetyl-5-methyl-2-quinolin-2-yl-1H-pyrazol-3-one
InChI:
InChI=1S/C15H13N3O2/c1-9-14(10(2)19)15(20)18(17-9)13-8-7-11-5-3-4-6-12(11)16-13/h3-8,17H,1-2H3
InChI Key:
MDTCIDWWQTWKMA-UHFFFAOYSA-N
SMILES:
CC(=O)c1c(C)nn(c1O)c1ccc2c(n1)cccc2
Properties
Complexity:
472
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.288g/mol
Monoisotopic Mass:
267.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.