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Home > Thiazole > 1351661-66-9
1351661-66-9 | N-(5,6-Dimethoxy-1,3-benzothiazol-2-yl)-N-methylglycine
CAS No: 1351661-66-9 Catalog No: AG01APPL MDL No:MFCD21091864
Product Description
Catalog Number:
AG01APPL
Chemical Name:
N-(5,6-Dimethoxy-1,3-benzothiazol-2-yl)-N-methylglycine
CAS Number:
1351661-66-9
Molecular Formula:
C12H14N2O4S
Molecular Weight:
282.3156
MDL Number:
MFCD21091864
IUPAC Name:
2-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)-methylamino]acetic acid
InChI:
InChI=1S/C12H14N2O4S/c1-14(6-11(15)16)12-13-7-4-8(17-2)9(18-3)5-10(7)19-12/h4-5H,6H2,1-3H3,(H,15,16)
InChI Key:
OKAALCMDIWYJRN-UHFFFAOYSA-N
SMILES:
COc1cc2sc(nc2cc1OC)N(CC(=O)O)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.067g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.314g/mol
Monoisotopic Mass:
282.067g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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