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88758-04-7 | Ethanimidamide, N-[(1-oxopentyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-04-7 Catalog No: AG004CEE MDL No:
Product Description
Catalog Number:
AG004CEE
Chemical Name:
Ethanimidamide, N-[(1-oxopentyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-04-7
Molecular Formula:
C16H19N3O3
Molecular Weight:
301.3404
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] pentanoate
InChI:
InChI=1S/C16H19N3O3/c1-2-3-9-15(20)22-19-14(17)11-21-13-8-4-6-12-7-5-10-18-16(12)13/h4-8,10H,2-3,9,11H2,1H3,(H2,17,19)
InChI Key:
IWKRLZVNSKQBPD-UHFFFAOYSA-N
SMILES:
CCCCC(=O)ONC(=N)COc1cccc2c1nccc2
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.143g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.346g/mol
Monoisotopic Mass:
301.143g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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