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15058-97-6 | 4-Thiazolidinone, 3-phenyl-5-(2-phenyldiazenyl)-2-thioxo-
CAS No: 15058-97-6 Catalog No: AG001MR2 MDL No:
Product Description
Catalog Number:
AG001MR2
Chemical Name:
4-Thiazolidinone, 3-phenyl-5-(2-phenyldiazenyl)-2-thioxo-
CAS Number:
15058-97-6
Molecular Formula:
C15H11N3OS2
Molecular Weight:
313.3973
IUPAC Name:
3-phenyl-5-phenyldiazenyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C15H11N3OS2/c19-14-13(17-16-11-7-3-1-4-8-11)21-15(20)18(14)12-9-5-2-6-10-12/h1-10,13H
InChI Key:
BHWBAYFTSZHZKD-UHFFFAOYSA-N
SMILES:
S=C1SC(C(=O)N1c1ccccc1)N=Nc1ccccc1
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.034g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.393g/mol
Monoisotopic Mass:
313.034g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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