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143034-82-6 | Benzamide, N-[2-(3-methyl-5-isoxazolyl)-2-oxoethyl]-
CAS No: 143034-82-6 Catalog No: AG007KHC MDL No:
Product Description
Catalog Number:
AG007KHC
Chemical Name:
Benzamide, N-[2-(3-methyl-5-isoxazolyl)-2-oxoethyl]-
CAS Number:
143034-82-6
Molecular Formula:
C13H12N2O3
Molecular Weight:
244.2460
IUPAC Name:
N-[2-(3-methyl-1,2-oxazol-5-yl)-2-oxoethyl]benzamide
InChI:
InChI=1S/C13H12N2O3/c1-9-7-12(18-15-9)11(16)8-14-13(17)10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,14,17)
InChI Key:
RIKBWUSUJXUREW-UHFFFAOYSA-N
SMILES:
Cc1noc(c1)C(=O)CNC(=O)c1ccccc1
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.25g/mol
Monoisotopic Mass:
244.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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