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23517-80-8 | 4-Thiazolidinone, 5-ethyl-3-(1-naphthalenyl)-2-thioxo-
CAS No: 23517-80-8 Catalog No: AG002NJD MDL No:
Product Description
Catalog Number:
AG002NJD
Chemical Name:
4-Thiazolidinone, 5-ethyl-3-(1-naphthalenyl)-2-thioxo-
CAS Number:
23517-80-8
Molecular Formula:
C15H13NOS2
Molecular Weight:
287.3998
IUPAC Name:
5-ethyl-3-naphthalen-1-yl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C15H13NOS2/c1-2-13-14(17)16(15(18)19-13)12-9-5-7-10-6-3-4-8-11(10)12/h3-9,13H,2H2,1H3
InChI Key:
KYHKTKHLTAXSLK-UHFFFAOYSA-N
SMILES:
CCC1SC(=S)N(C1=O)c1cccc2c1cccc2
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.044g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.395g/mol
Monoisotopic Mass:
287.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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