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88757-78-2 | Ethanimidamide, N-[(cyclopropylcarbonyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88757-78-2 Catalog No: AG004CLY MDL No:
Product Description
Catalog Number:
AG004CLY
Chemical Name:
Ethanimidamide, N-[(cyclopropylcarbonyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88757-78-2
Molecular Formula:
C15H15N3O3
Molecular Weight:
285.2979
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] cyclopropanecarboxylate
InChI:
InChI=1S/C15H15N3O3/c16-13(18-21-15(19)11-6-7-11)9-20-12-5-1-3-10-4-2-8-17-14(10)12/h1-5,8,11H,6-7,9H2,(H2,16,18)
InChI Key:
JSRCAUTXPPDAGH-UHFFFAOYSA-N
SMILES:
N=C(COc1cccc2c1nccc2)NOC(=O)C1CC1
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.303g/mol
Monoisotopic Mass:
285.111g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.9
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