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764651-43-6 | 2-Thiazolidinethione, 3-(1-oxohexyl)-4-phenyl-, (4R)-
CAS No: 764651-43-6 Catalog No: AG005LGU MDL No:
Product Description
Catalog Number:
AG005LGU
Chemical Name:
2-Thiazolidinethione, 3-(1-oxohexyl)-4-phenyl-, (4R)-
CAS Number:
764651-43-6
Molecular Formula:
C15H19NOS2
Molecular Weight:
293.4475
IUPAC Name:
1-[(4R)-4-phenyl-2-sulfanylidene-1,3-thiazolidin-3-yl]hexan-1-one
InChI:
InChI=1S/C15H19NOS2/c1-2-3-5-10-14(17)16-13(11-19-15(16)18)12-8-6-4-7-9-12/h4,6-9,13H,2-3,5,10-11H2,1H3/t13-/m0/s1
InChI Key:
GBKNFGINDPIADJ-ZDUSSCGKSA-N
SMILES:
CCCCCC(=O)N1C(=S)SC[C@H]1c1ccccc1
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
293.091g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.443g/mol
Monoisotopic Mass:
293.091g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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