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68516-67-6 | 5-[(6-ethoxy-1-ethyl-(1H)-quinolin-2-ylidene)ethylidene]-3-ethyl-2-thioxothiazolidin-4-one
CAS No: 68516-67-6 Catalog No: AG00FO6S MDL No:
Product Description
Catalog Number:
AG00FO6S
Chemical Name:
5-[(6-ethoxy-1-ethyl-(1H)-quinolin-2-ylidene)ethylidene]-3-ethyl-2-thioxothiazolidin-4-one
CAS Number:
68516-67-6
IUPAC Name:
(5Z)-5-[(2E)-2-(6-ethoxy-1-ethylquinolin-2-ylidene)ethylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C20H22N2O2S2/c1-4-21-15(9-12-18-19(23)22(5-2)20(25)26-18)8-7-14-13-16(24-6-3)10-11-17(14)21/h7-13H,4-6H2,1-3H3/b15-9+,18-12-
InChI Key:
FGMSIGOWJWPECJ-DWFDGKQZSA-N
EC Number:
271-171-9
Properties
Complexity:
656
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
386.112g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.528g/mol
Monoisotopic Mass:
386.112g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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