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86134-15-8 | Benzamide, 2-amino-N-(3-methyl-5-isoxazolyl)-
CAS No: 86134-15-8 Catalog No: AG004TWP MDL No:
Product Description
Catalog Number:
AG004TWP
Chemical Name:
Benzamide, 2-amino-N-(3-methyl-5-isoxazolyl)-
CAS Number:
86134-15-8
Molecular Formula:
C11H11N3O2
Molecular Weight:
217.2239
IUPAC Name:
2-amino-N-(3-methyl-1,2-oxazol-5-yl)benzamide
InChI:
InChI=1S/C11H11N3O2/c1-7-6-10(16-14-7)13-11(15)8-4-2-3-5-9(8)12/h2-6H,12H2,1H3,(H,13,15)
InChI Key:
OPRCUUUMIOKKKX-UHFFFAOYSA-N
SMILES:
Cc1noc(c1)NC(=O)c1ccccc1N
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.228g/mol
Monoisotopic Mass:
217.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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