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88758-62-7 | Ethanimidamide, N-[(phenylacetyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-62-7 Catalog No: AG004DQN MDL No:
Product Description
Catalog Number:
AG004DQN
Chemical Name:
Ethanimidamide, N-[(phenylacetyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-62-7
Molecular Formula:
C19H17N3O3
Molecular Weight:
335.3566
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] 2-phenylacetate
InChI:
InChI=1S/C19H17N3O3/c20-17(22-25-18(23)12-14-6-2-1-3-7-14)13-24-16-10-4-8-15-9-5-11-21-19(15)16/h1-11H,12-13H2,(H2,20,22)
InChI Key:
BLTDXDVPLRTBIF-UHFFFAOYSA-N
SMILES:
N=C(COc1cccc2c1nccc2)NOC(=O)Cc1ccccc1
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.127g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.363g/mol
Monoisotopic Mass:
335.127g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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