Account Fasitibant free base
- Catalog No. :
- ACAXRW003
- CAS No. :
- 869939-83-3
- Molecular Formula :
- C36H49Cl2N6O6S+
- Molecular Weight :
- 764.80
IUPAC Name:(S)-4-amino-5-(4-(4-((2,4-dichloro-3-(((2,4-dimethylquinolin-8-yl)oxy)methyl)phenyl)sulfonamido)tetrahydro-2H-pyran-4-carbonyl)piperazin-1-yl)-N,N,N-trimethyl-5-oxopentan-1-aminium
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Product Information
| Product Name | Fasitibant free base |
|---|---|
| IUPAC Name | (S)-4-amino-5-(4-(4-((2,4-dichloro-3-(((2,4-dimethylquinolin-8-yl)oxy)methyl)phenyl)sulfonamido)tetrahydro-2H-pyran-4-carbonyl)piperazin-1-yl)-N,N,N-trimethyl-5-oxopentan-1-aminium |
| Molecular Formula | C36H49Cl2N6O6S+ |
| Molecular Weight | 764.80 |
| SMILES | O=C(N1CCN(C(C2(NS(=O)(C3=CC=C(Cl)C(COC4=C5N=C(C)C=C(C)C5=CC=C4)=C3Cl)=O)CCOCC2)=O)CC1)[C@@H](N)CCC[N+](C)(C)C |
| InChI Key | FQVSDHOWSLEEKJ-LJAQVGFWSA-N |
| Synonym | Fasitibant | 1-PIPERAZINEPENTANAMINIUM, .DELTA.-AMINO-4-((4-(((2,4-DICHLORO-3-(((2,4-DIMETHYL-8-QUINOLINYL)OXY)METHYL)PHENYL)SULFONYL)AMINO)TETRAHYDRO-2H-PYRAN-4-YL)CARBONYL)-N,N,N-TRIMETHYL-.EPSILON.-OXO-, (.DELTA.S)- | Fasitibant free base | Fasitibant |
| CAS No. | 869939-83-3 |
| PubChem CID | 11498853 |
Synthetic Route by SureRoute
2. ACAXRW003 Molecular Building Block Synthetic Route
(S)-4-Amino-5-(4-(4-((2,4-dichloro-3-(((2,4-dimethylquinolin-8-yl)oxy)methyl)phenyl)sulfonamido)tetrahydro-2H-pyran-4-carbonyl)piperazin-1-yl)-N,N,N-trimethyl-5-oxopentan-1-aminium chloride
(S)-4-Amino-5-(4-(4-(2,4-dichloro-3-(((2,4-dimethylquinolin-8-yl)oxy)methyl)phenylsulfonamido)tetrahydro-2H-pyran-4-carbonyl)piperazin-1-yl)-N,N,N-trimethyl-5-oxopentan-1-aminium chloride hydrochloride
(S)-N-(3-(4-Carbamimidoylbenzamido)propyl)-1-((2,4-dichloro-3-(((2,4-dimethylquinolin-8-yl)oxy)methyl)phenyl)sulfonyl)pyrrolidine-2-carboxamide dihydrochloride