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4490-97-5 | Acetamide, N,N'-(dithiodi-2,1-phenylene)bis-
CAS No: 4490-97-5 Catalog No: AG00713T MDL No:
Product Description
Catalog Number:
AG00713T
Chemical Name:
Acetamide, N,N'-(dithiodi-2,1-phenylene)bis-
CAS Number:
4490-97-5
Molecular Formula:
C16H16N2O2S2
Molecular Weight:
332.4404
IUPAC Name:
N-[2-[(2-acetamidophenyl)disulfanyl]phenyl]acetamide
InChI:
InChI=1S/C16H16N2O2S2/c1-11(19)17-13-7-3-5-9-15(13)21-22-16-10-6-4-8-14(16)18-12(2)20/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChI Key:
MFXYHRRPXLOFRZ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccccc1SSc1ccccc1NC(=O)C
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.065g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
332.436g/mol
Monoisotopic Mass:
332.065g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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