200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 303162-80-3
303162-80-3 | Benzenepropanamide, N-[4-[2-ethyl-4-(3-methylphenyl)-5-thiazolyl]-2-pyridinyl]-
CAS No: 303162-80-3 Catalog No: AG002ZQ1 MDL No:
Product Description
Catalog Number:
AG002ZQ1
Chemical Name:
Benzenepropanamide, N-[4-[2-ethyl-4-(3-methylphenyl)-5-thiazolyl]-2-pyridinyl]-
CAS Number:
303162-80-3
Molecular Formula:
C26H25N3OS
Molecular Weight:
427.5612
IUPAC Name:
N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]pyridin-2-yl]-3-phenylpropanamide
InChI:
InChI=1S/C26H25N3OS/c1-3-24-29-25(20-11-7-8-18(2)16-20)26(31-24)21-14-15-27-22(17-21)28-23(30)13-12-19-9-5-4-6-10-19/h4-11,14-17H,3,12-13H2,1-2H3,(H,27,28,30)
InChI Key:
XLMIKSYZFWHWMU-UHFFFAOYSA-N
SMILES:
CCc1nc(c(s1)c1ccnc(c1)NC(=O)CCc1ccccc1)c1cccc(c1)C
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.172g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
427.566g/mol
Monoisotopic Mass:
427.172g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
Literature
| Title | Journal |
|---|---|
| Novel inhibitor of p38 MAP kinase as an anti-TNF-alpha drug: discovery of N-[4-[2-ethyl-4-(3-methylphenyl)-1,3-thiazol-5-yl]-2-pyridyl]benzamide (TAK-715) as a potent and orally active anti-rheumatoid arthritis agent. | Journal of medicinal chemistry 20050922 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.