Account (S)-2-(5,7-Dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid
- Catalog No. :
- ACIAMF343
- CAS No. :
- 851785-70-1
- Molecular Formula :
- C20H20Cl2N2O5S
- Molecular Weight :
- 471.36
IUPAC Name:(S)-2-(5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid
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Product Information
| Product Name | (S)-2-(5,7-Dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid |
|---|---|
| IUPAC Name | (S)-2-(5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid |
| Molecular Formula | C20H20Cl2N2O5S |
| Molecular Weight | 471.36 |
| SMILES | O=C(O)[C@@H](NC(C1=C(Cl)C2=C(CNCC2)C=C1Cl)=O)CC3=CC=CC(S(=O)(C)=O)=C3 |
| InChI Key | YUSRSRSJRRHCQF-INIZCTEOSA-N |
| Synonym | lifitegrast impurity C;Lifitegrast Impurity 25;ifitegrast impurity C;(S) - 2 - (5,7-dichloro-1,2,3,4-tetrahydroneneneba isoquinolin-6-formamido) - 3 - (3 - (methylsulfonyl) phenyl) propionic acid hydrochloride;L-Phenylalanine, N-[(5,7-dichloro-1,2,3,4-tetrahydro-6-isoquinolinyl)carbonyl]-3-(methylsulfonyl)-;Lifitegrast Impurity N12;Lifitegrast Impurity 23 Monomer |
| CAS No. | 851785-70-1 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACIAMF343 Molecular Building Block Synthetic Route
Benzyl (S)-2-(5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoate hydrochloride
(S)-2-(2-(Benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid
(R)-2-(2-(Benzofuran-6-carbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxamido)-3-(3-(methylsulfonyl)phenyl)propanoic acid