200,000+ products from a single source!
sales@angenechem.com
744242-03-3 | 2-[2-(3,5-dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidin-4-one
CAS No: 744242-03-3 Catalog No: AG019JEU MDL No:MFCD05267648
Product Description
Catalog Number:
AG019JEU
Chemical Name:
2-[2-(3,5-dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidin-4-one
CAS Number:
744242-03-3
Molecular Formula:
C13H13NO2S
Molecular Weight:
247.3128
MDL Number:
MFCD05267648
IUPAC Name:
2-[2-(3,5-dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidin-4-one
InChI:
InChI=1S/C13H13NO2S/c1-8-3-9(2)5-10(4-8)11(15)6-13-14-12(16)7-17-13/h3-6H,7H2,1-2H3,(H,14,16)
InChI Key:
YJOZNRBAKVSPJY-UHFFFAOYSA-N
SMILES:
O=C(c1cc(C)cc(c1)C)C=C1SCC(=O)N1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.067g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.312g/mol
Monoisotopic Mass:
247.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.