Account (S)-2-(5-(((R)-2-Amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoic acid compound with 2,2,2-trifluoroacetic acid (1:1)
- Catalog No. :
- ACLCMC050
- CAS No. :
- 1217471-51-6
- Molecular Formula :
- C23H28F3N3O5S2
- Molecular Weight :
- 547.62
IUPAC Name:(5-(((R)-2-amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-carbonyl)-L-methionine--2,2,2-trifluoroacetic acid (1/1)
![(S)-2-(5-(((R)-2-Amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoic acid compound with 2,2,2-trifluoroacetic acid (1:1) structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (S)-2-(5-(((R)-2-Amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoic acid compound with 2,2,2-trifluoroacetic acid (1:1) |
|---|---|
| IUPAC Name | (5-(((R)-2-amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-carbonyl)-L-methionine--2,2,2-trifluoroacetic acid (1/1) |
| Molecular Formula | C23H28F3N3O5S2 |
| Molecular Weight | 547.62 |
| SMILES | N[C@@H](CS)CNC1=CC(C2=CC=CC=C2)=C(C=C1)C(N[C@@H](CCSC)C(O)=O)=O.FC(F)(C(O)=O)F |
| InChI Key | IAVHISGQCODLHL-WSCVZUBPSA-N |
| Synonym | FTI 276 TFA;(S)-2-(5-(((R)-2-Amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoic acid compound with 2,2,2-trifluoroacetic acid (1:1) |
| CAS No. | 1217471-51-6 |
| PubChem CID | 395753 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H302-H318
- Precautionary Statement(s)
- P280-P301+P312+P330-P305+P351+P338+P310
Synthetic Route by SureRoute
2. ACLCMC050 Molecular Building Block Synthetic Route
(S)-2-(5-(((R)-2-Amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoic acid
(S)-Methyl 2-(5-(((R)-2-amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoate 2,2,2-trifluoroacetate
(S)-methyl 2-(5-(((R)-2-amino-3-mercaptopropyl)amino)-[1,1'-biphenyl]-2-ylcarboxamido)-4-(methylthio)butanoate hydrochloride