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77771-22-3 | (8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-pyridin-3-yl-methanone
CAS No: 77771-22-3 Catalog No: AG0057S8 MDL No:
Product Description
Catalog Number:
AG0057S8
Chemical Name:
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-pyridin-3-yl-methanone
CAS Number:
77771-22-3
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)-pyridin-3-ylmethanone
InChI:
InChI=1S/C15H14N2O2/c18-13-7-1-4-11-6-3-9-17(14(11)13)15(19)12-5-2-8-16-10-12/h1-2,4-5,7-8,10,18H,3,6,9H2
InChI Key:
GUQABSUKMJPZHH-UHFFFAOYSA-N
SMILES:
O=C(N1CCCc2c1c(O)ccc2)c1cccnc1
EC Number:
278-765-7
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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