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88758-24-1 | Ethanimidamide, N-[(butoxyacetyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-24-1 Catalog No: AG004C7A MDL No:
Product Description
Catalog Number:
AG004C7A
Chemical Name:
Ethanimidamide, N-[(butoxyacetyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-24-1
Molecular Formula:
C17H21N3O4
Molecular Weight:
331.3663
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] 2-butoxyacetate
InChI:
InChI=1S/C17H21N3O4/c1-2-3-10-22-12-16(21)24-20-15(18)11-23-14-8-4-6-13-7-5-9-19-17(13)14/h4-9H,2-3,10-12H2,1H3,(H2,18,20)
InChI Key:
OLYFTXJMMAWARI-UHFFFAOYSA-N
SMILES:
CCCCOCC(=O)ONC(=N)COc1cccc2c1nccc2
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.153g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.372g/mol
Monoisotopic Mass:
331.153g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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