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104388-94-5 | Ethanediamide,N1-(6-methoxy-2-benzothiazolyl)-N2-methyl-
CAS No: 104388-94-5 Catalog No: AG007HUD MDL No:
Product Description
Catalog Number:
AG007HUD
Chemical Name:
Ethanediamide,N1-(6-methoxy-2-benzothiazolyl)-N2-methyl-
CAS Number:
104388-94-5
Molecular Formula:
C11H11N3O3S
Molecular Weight:
265.2883
IUPAC Name:
N'-(6-methoxy-1,3-benzothiazol-2-yl)-N'-methyloxamide
InChI:
InChI=1S/C11H11N3O3S/c1-14(10(16)9(12)15)11-13-7-4-3-6(17-2)5-8(7)18-11/h3-5H,1-2H3,(H2,12,15)
InChI Key:
MTQHJGZEVSMWSF-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)sc(n2)N(C(=O)C(=O)N)C
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.287g/mol
Monoisotopic Mass:
265.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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