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499986-54-8 | Benzoic acid, 2-[[2-(3,4-dimethoxyphenyl)-3-thiazolidinyl]carbonyl]- (9CI)
CAS No: 499986-54-8 Catalog No: AG00DOA4 MDL No:
Product Description
Catalog Number:
AG00DOA4
Chemical Name:
Benzoic acid, 2-[[2-(3,4-dimethoxyphenyl)-3-thiazolidinyl]carbonyl]- (9CI)
CAS Number:
499986-54-8
IUPAC Name:
2-[2-(3,4-dimethoxyphenyl)-1,3-thiazolidine-3-carbonyl]benzoic acid
InChI:
InChI=1S/C19H19NO5S/c1-24-15-8-7-12(11-16(15)25-2)18-20(9-10-26-18)17(21)13-5-3-4-6-14(13)19(22)23/h3-8,11,18H,9-10H2,1-2H3,(H,22,23)
InChI Key:
STNQDSKNJKXALL-UHFFFAOYSA-N
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.098g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.423g/mol
Monoisotopic Mass:
373.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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