200,000+ products from a single source!
sales@angenechem.com
125734-22-7 | 2,4-Thiazolidinedione, 5-[[4-(1-oxo-3-phenylpropyl)phenyl]methyl]-
CAS No: 125734-22-7 Catalog No: AG000OL3 MDL No:
Product Description
Catalog Number:
AG000OL3
Chemical Name:
2,4-Thiazolidinedione, 5-[[4-(1-oxo-3-phenylpropyl)phenyl]methyl]-
CAS Number:
125734-22-7
Molecular Formula:
C19H17NO3S
Molecular Weight:
339.4082
IUPAC Name:
5-[[4-(3-phenylpropanoyl)phenyl]methyl]-1,3-thiazolidine-2,4-dione
InChI:
InChI=1S/C19H17NO3S/c21-16(11-8-13-4-2-1-3-5-13)15-9-6-14(7-10-15)12-17-18(22)20-19(23)24-17/h1-7,9-10,17H,8,11-12H2,(H,20,22,23)
InChI Key:
KMRWVKUAYIEHSE-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(S1)Cc1ccc(cc1)C(=O)CCc1ccccc1
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.093g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.409g/mol
Monoisotopic Mass:
339.093g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.