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88758-29-6 | Ethanimidamide, N-[(propoxycarbonyl)oxy]-2-(8-quinolinyloxy)-
CAS No: 88758-29-6 Catalog No: AG004DVG MDL No:
Product Description
Catalog Number:
AG004DVG
Chemical Name:
Ethanimidamide, N-[(propoxycarbonyl)oxy]-2-(8-quinolinyloxy)-
CAS Number:
88758-29-6
Molecular Formula:
C15H17N3O4
Molecular Weight:
303.3132
IUPAC Name:
[(1-amino-2-quinolin-8-yloxyethylidene)amino] propyl carbonate
InChI:
InChI=1S/C15H17N3O4/c1-2-9-20-15(19)22-18-13(16)10-21-12-7-3-5-11-6-4-8-17-14(11)12/h3-8H,2,9-10H2,1H3,(H2,16,18)
InChI Key:
NASKMCFNVSGITN-UHFFFAOYSA-N
SMILES:
CCCOC(=O)ONC(=N)COc1cccc2c1nccc2
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.122g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.318g/mol
Monoisotopic Mass:
303.122g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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