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23509-81-1 | 5-Thiazolidinecarboxylic acid, 3,3'-ethylenebis[4-hydroxy-4-methyl-2-thioxo-, diethyl ester (8CI)
CAS No: 23509-81-1 Catalog No: AG002NGQ MDL No:
Product Description
Catalog Number:
AG002NGQ
Chemical Name:
5-Thiazolidinecarboxylic acid, 3,3'-ethylenebis[4-hydroxy-4-methyl-2-thioxo-, diethyl ester (8CI)
CAS Number:
23509-81-1
IUPAC Name:
ethyl 3-[2-(5-ethoxycarbonyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-3-yl)ethyl]-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
InChI:
InChI=1S/C16H24N2O6S4/c1-5-23-11(19)9-15(3,21)17(13(25)27-9)7-8-18-14(26)28-10(16(18,4)22)12(20)24-6-2/h9-10,21-22H,5-8H2,1-4H3
InChI Key:
FONUDMIOOCPPCQ-UHFFFAOYSA-N
Properties
Complexity:
624
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.052g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
468.616g/mol
Monoisotopic Mass:
468.052g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
214A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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