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88584-27-4 | 4-Oxazolecarboxamide, 5-ethoxy-N-(iminophenylmethyl)-2-phenyl-
CAS No: 88584-27-4 Catalog No: AG008BBR MDL No:
Product Description
Catalog Number:
AG008BBR
Chemical Name:
4-Oxazolecarboxamide, 5-ethoxy-N-(iminophenylmethyl)-2-phenyl-
CAS Number:
88584-27-4
Molecular Formula:
C19H17N3O3
Molecular Weight:
335.3566
IUPAC Name:
N-[amino(phenyl)methylidene]-5-ethoxy-2-phenyl-1,3-oxazole-4-carboxamide
InChI:
InChI=1S/C19H17N3O3/c1-2-24-19-15(21-18(25-19)14-11-7-4-8-12-14)17(23)22-16(20)13-9-5-3-6-10-13/h3-12H,2H2,1H3,(H2,20,22,23)
InChI Key:
VVGHTWWRXYGICW-UHFFFAOYSA-N
SMILES:
CCOc1oc(nc1C(=O)NC(=N)c1ccccc1)c1ccccc1
Properties
Complexity:
471
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:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.363g/mol
Monoisotopic Mass:
335.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
90.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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