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76336-03-3 | Ethyl 1-benzyl-4-hydroxy-7-methyl-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylate
CAS No: 76336-03-3 Catalog No: AG0056DU MDL No:MFCD17011922
Product Description
Catalog Number:
AG0056DU
Chemical Name:
Ethyl 1-benzyl-4-hydroxy-7-methyl-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylate
CAS Number:
76336-03-3
Molecular Formula:
C19H18N2O4
Molecular Weight:
338.3572
MDL Number:
MFCD17011922
IUPAC Name:
ethyl 1-benzyl-4-hydroxy-7-methyl-2-oxo-1,8-naphthyridine-3-carboxylate
InChI:
InChI=1S/C19H18N2O4/c1-3-25-19(24)15-16(22)14-10-9-12(2)20-17(14)21(18(15)23)11-13-7-5-4-6-8-13/h4-10,22H,3,11H2,1-2H3
InChI Key:
GUJUFQXQKVJRKG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(O)c2ccc(nc2n(c1=O)Cc1ccccc1)C
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.127g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
338.363g/mol
Monoisotopic Mass:
338.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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