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99541-70-5 | Benzamide, 2-hydroxy-N-[2-(2-methoxyphenyl)-4-oxo-3-thiazolidinyl]-
CAS No: 99541-70-5 Catalog No: AG006NPO MDL No:
Product Description
Catalog Number:
AG006NPO
Chemical Name:
Benzamide, 2-hydroxy-N-[2-(2-methoxyphenyl)-4-oxo-3-thiazolidinyl]-
CAS Number:
99541-70-5
Molecular Formula:
C17H16N2O4S
Molecular Weight:
344.3849
IUPAC Name:
2-hydroxy-N-[2-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzamide
InChI:
InChI=1S/C17H16N2O4S/c1-23-14-9-5-3-7-12(14)17-19(15(21)10-24-17)18-16(22)11-6-2-4-8-13(11)20/h2-9,17,20H,10H2,1H3,(H,18,22)
InChI Key:
JRRMXQLEEOZILG-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1SCC(=O)N1NC(=O)c1ccccc1O
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.083g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
344.385g/mol
Monoisotopic Mass:
344.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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