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84548-18-5 | 3-Quinolinecarboxamide, 1,2,5,6,7,8-hexahydro-2,5-dioxo-
CAS No: 84548-18-5 Catalog No: AG008HN0 MDL No:MFCD00454203
Product Description
Catalog Number:
AG008HN0
Chemical Name:
3-Quinolinecarboxamide, 1,2,5,6,7,8-hexahydro-2,5-dioxo-
CAS Number:
84548-18-5
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD00454203
IUPAC Name:
2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide
InChI:
InChI=1S/C10H10N2O3/c11-9(14)6-4-5-7(12-10(6)15)2-1-3-8(5)13/h4H,1-3H2,(H2,11,14)(H,12,15)
InChI Key:
CBYCFZZAGFYEDF-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cc(C(=O)N)c(=O)[nH]2
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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