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17230-85-2 | Amquinolate
CAS No: 17230-85-2 Catalog No: AG00AUT7 MDL No:
Product Description
Catalog Number:
AG00AUT7
Chemical Name:
Amquinolate
CAS Number:
17230-85-2
IUPAC Name:
methyl 7-(diethylamino)-4-oxo-6-propyl-1H-quinoline-3-carboxylate
InChI:
InChI=1S/C18H24N2O3/c1-5-8-12-9-13-15(10-16(12)20(6-2)7-3)19-11-14(17(13)21)18(22)23-4/h9-11H,5-8H2,1-4H3,(H,19,21)
InChI Key:
NMYCTBARPUAEQN-UHFFFAOYSA-N
UNII:
21N28Z70CI
NSC Number:
339053
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.179g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.401g/mol
Monoisotopic Mass:
316.179g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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