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6913-28-6 | (4Z)-3-Ethyl-4-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylid ene]-2-thioxo-1,3-thiazolidin-5-one
CAS No: 6913-28-6 Catalog No: AG00FV25 MDL No:
Product Description
Catalog Number:
AG00FV25
Chemical Name:
(4Z)-3-Ethyl-4-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylid ene]-2-thioxo-1,3-thiazolidin-5-one
CAS Number:
6913-28-6
IUPAC Name:
3-ethyl-4-[2-(3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-thiazolidin-5-one
InChI:
InChI=1S/C16H16N2OS3/c1-3-17-11-7-5-6-8-13(11)21-14(17)10-9-12-15(19)22-16(20)18(12)4-2/h5-10H,3-4H2,1-2H3
InChI Key:
LTGKFXQRZWROBR-UHFFFAOYSA-N
Properties
Complexity:
544
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.042g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.497g/mol
Monoisotopic Mass:
348.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.5
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