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863324-40-7 | 2-Thiazolidinethione, 3-[(4-methoxyphenyl)acetyl]-
CAS No: 863324-40-7 Catalog No: AG01B5WS MDL No:MFCD19335474
Product Description
Catalog Number:
AG01B5WS
Chemical Name:
2-Thiazolidinethione, 3-[(4-methoxyphenyl)acetyl]-
CAS Number:
863324-40-7
MDL Number:
MFCD19335474
IUPAC Name:
2-(4-methoxyphenyl)-1-(2-sulfanylidene-1,3-thiazolidin-3-yl)ethanone
InChI:
InChI=1S/C12H13NO2S2/c1-15-10-4-2-9(3-5-10)8-11(14)13-6-7-17-12(13)16/h2-5H,6-8H2,1H3
InChI Key:
UKFNNQMHTRPYLN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CC(=O)N1CCSC1=S
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.039g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.361g/mol
Monoisotopic Mass:
267.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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