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Home > Pyridines > 125055-59-6
125055-59-6 | 4H-Pyrido[1,2-a]pyrimidine-3-carboxamide, 6-methyl-N-octyl-4-oxo-
CAS No: 125055-59-6 Catalog No: AG000N1Y MDL No:
Product Description
Catalog Number:
AG000N1Y
Chemical Name:
4H-Pyrido[1,2-a]pyrimidine-3-carboxamide, 6-methyl-N-octyl-4-oxo-
CAS Number:
125055-59-6
Molecular Formula:
C18H25N3O2
Molecular Weight:
315.4100
IUPAC Name:
6-methyl-N-octyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
InChI:
InChI=1S/C18H25N3O2/c1-3-4-5-6-7-8-12-19-17(22)15-13-20-16-11-9-10-14(2)21(16)18(15)23/h9-11,13H,3-8,12H2,1-2H3,(H,19,22)
InChI Key:
GITXJJGLSZCFIR-UHFFFAOYSA-N
SMILES:
CCCCCCCCNC(=O)c1cnc2n(c1=O)c(C)ccc2
Properties
Complexity:
585
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.195g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.417g/mol
Monoisotopic Mass:
315.195g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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