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871982-49-9 | 4-Thiazolidinone, 3-(4-methoxyphenyl)-5-(phenylazo)-2-thioxo-
CAS No: 871982-49-9 Catalog No: AG004NKH MDL No:
Product Description
Catalog Number:
AG004NKH
Chemical Name:
4-Thiazolidinone, 3-(4-methoxyphenyl)-5-(phenylazo)-2-thioxo-
CAS Number:
871982-49-9
Molecular Formula:
C16H13N3O2S2
Molecular Weight:
343.4233
IUPAC Name:
3-(4-methoxyphenyl)-5-phenyldiazenyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C16H13N3O2S2/c1-21-13-9-7-12(8-10-13)19-15(20)14(23-16(19)22)18-17-11-5-3-2-4-6-11/h2-10,14H,1H3
InChI Key:
RCAJQCNEDQMTHA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N1C(=S)SC(C1=O)N=Nc1ccccc1
Properties
Complexity:
472
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.045g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.419g/mol
Monoisotopic Mass:
343.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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