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88758-15-0 | Ethanimidamide, N-[(1-oxohexyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-15-0 Catalog No: AG008BM1 MDL No:
Product Description
Catalog Number:
AG008BM1
Chemical Name:
Ethanimidamide, N-[(1-oxohexyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-15-0
Molecular Formula:
C17H21N3O3
Molecular Weight:
315.3669
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] hexanoate
InChI:
InChI=1S/C17H21N3O3/c1-2-3-4-10-16(21)23-20-15(18)12-22-14-9-5-7-13-8-6-11-19-17(13)14/h5-9,11H,2-4,10,12H2,1H3,(H2,18,20)
InChI Key:
RNCDDAHGSGUFIY-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)ONC(=N)COc1cccc2c1nccc2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.158g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.373g/mol
Monoisotopic Mass:
315.158g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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