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89205-15-2 | 4-Oxazolecarboxamide, 5-(3,4,5-trimethoxyphenyl)-
CAS No: 89205-15-2 Catalog No: AG00464X MDL No:
Product Description
Catalog Number:
AG00464X
Chemical Name:
4-Oxazolecarboxamide, 5-(3,4,5-trimethoxyphenyl)-
CAS Number:
89205-15-2
Molecular Formula:
C13H14N2O5
Molecular Weight:
278.2607
IUPAC Name:
5-(3,4,5-trimethoxyphenyl)-1,3-oxazole-4-carboxamide
InChI:
InChI=1S/C13H14N2O5/c1-17-8-4-7(5-9(18-2)12(8)19-3)11-10(13(14)16)15-6-20-11/h4-6H,1-3H3,(H2,14,16)
InChI Key:
WXMOUEQTJQUMMG-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1OC)OC)c1ocnc1C(=O)N
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.264g/mol
Monoisotopic Mass:
278.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
96.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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