200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1144853-59-7
1144853-59-7 | Propanedinitrile, 2-[1,2-dihydro-1-[(4-methoxyphenyl)methyl]-2-oxo-5-(4-thiomorpholinylsulfonyl)-3H-indol-3-ylidene]-
CAS No: 1144853-59-7 Catalog No: AG000EII MDL No:
Product Description
Catalog Number:
AG000EII
Chemical Name:
Propanedinitrile, 2-[1,2-dihydro-1-[(4-methoxyphenyl)methyl]-2-oxo-5-(4-thiomorpholinylsulfonyl)-3H-indol-3-ylidene]-
CAS Number:
1144853-59-7
Molecular Formula:
C23H20N4O4S2
Molecular Weight:
480.5593
IUPAC Name:
2-[1-[(4-methoxyphenyl)methyl]-2-oxo-5-thiomorpholin-4-ylsulfonylindol-3-ylidene]propanedinitrile
InChI:
InChI=1S/C23H20N4O4S2/c1-31-18-4-2-16(3-5-18)15-27-21-7-6-19(33(29,30)26-8-10-32-11-9-26)12-20(21)22(23(27)28)17(13-24)14-25/h2-7,12H,8-11,15H2,1H3
InChI Key:
YEEKKDMABQLVBJ-UHFFFAOYSA-N
SMILES:
N#CC(=C1C(=O)N(c2c1cc(cc2)S(=O)(=O)N1CCSCC1)Cc1ccc(cc1)OC)C#N
Properties
Complexity:
971
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.093g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
480.557g/mol
Monoisotopic Mass:
480.093g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
148A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Synthesis and in vitro evaluation of sulfonamide isatin Michael acceptors as small molecule inhibitors of caspase-6. | Journal of medicinal chemistry 20090423 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.