Products 521985-36-4
CAS 521985-36-4 appears in our catalog under these names: SIS3 – Smad3 inhibitor SIS3, SIS3, SIS3 (free base), 98.11%, 98.11%, SIS3 (free base), 98.02%. Offered by: GLPBio, Biosynth, Chemat, MedChemExpress. Available pack sizes: 10mg, 5mg, 10mM (in 1ml dmso), 25mg, 50mg, 100mg, 5 mg, 25 mg.
SIS3 free base is an enamide resulting from the formal condensation of the amino group of 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline with the carboxy group of (2E)-3-(1-methyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)acrylic acid. It has a role as a Smad3 inhibitor. It is a tertiary carboxamide, a member of isoquinolines, a monocarboxylic acid amide, an aromatic ether, a pyrrolopyridine and an enamide. It is a conjugate base of a SIS3 free base(1+).
Source: ChEBI
| Molecular formula | C28H27N3O3 |
|---|---|
| Molecular weight | 453.5 g/mol |
| IUPAC name | (E)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-2-phenylpyrrolo[2,3-b]pyridin-3-yl)prop-2-en-1-one |
| InChIKey | IJYPHMXWKKKHGT-VAWYXSNFSA-N |
| SMILES | CN1C(=C(C2=C1N=CC=C2)/C=C/C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C5=CC=CC=C5 |
Computed by PubChem (NCBI)