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23509-78-6 | 2-Thiazolidinethione, 3-(3-chlorophenyl)-4-hydroxy-4-phenyl-
CAS No: 23509-78-6 Catalog No: AG002NGT MDL No:
Product Description
Catalog Number:
AG002NGT
Chemical Name:
2-Thiazolidinethione, 3-(3-chlorophenyl)-4-hydroxy-4-phenyl-
CAS Number:
23509-78-6
Molecular Formula:
C15H12ClNOS2
Molecular Weight:
321.8449
IUPAC Name:
3-(3-chlorophenyl)-4-hydroxy-4-phenyl-1,3-thiazolidine-2-thione
InChI:
InChI=1S/C15H12ClNOS2/c16-12-7-4-8-13(9-12)17-14(19)20-10-15(17,18)11-5-2-1-3-6-11/h1-9,18H,10H2
InChI Key:
FYSHQZSXWNAASC-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)N1C(=S)SCC1(O)c1ccccc1
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.005g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.837g/mol
Monoisotopic Mass:
321.005g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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