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183314-30-9 | Ethanone, 1-[4-[(2,7-dimethyl-1,8-naphthyridin-4-yl)amino]phenyl]-
CAS No: 183314-30-9 Catalog No: AG0027I6 MDL No:
Product Description
Catalog Number:
AG0027I6
Chemical Name:
Ethanone, 1-[4-[(2,7-dimethyl-1,8-naphthyridin-4-yl)amino]phenyl]-
CAS Number:
183314-30-9
Molecular Formula:
C18H17N3O
Molecular Weight:
291.3471
IUPAC Name:
1-[4-[(2,7-dimethyl-1,8-naphthyridin-4-yl)amino]phenyl]ethanone
InChI:
InChI=1S/C18H17N3O/c1-11-4-9-16-17(10-12(2)20-18(16)19-11)21-15-7-5-14(6-8-15)13(3)22/h4-10H,1-3H3,(H,19,20,21)
InChI Key:
YYUBCFYZMATEJH-UHFFFAOYSA-N
SMILES:
Cc1cc(Nc2ccc(cc2)C(=O)C)c2c(n1)nc(cc2)C
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.354g/mol
Monoisotopic Mass:
291.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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