Account 3-((S)-2-((1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxo-1-(2,2,2-trifluoroacetamido)ethyl)adamantan-1-yl 2,2,2-trifluoroacetate
- Catalog No. :
- ACYIUA167
- CAS No. :
- 865999-68-4
- Molecular Formula :
- C22H23F6N3O4
- Molecular Weight :
- 507.43
IUPAC Name:3-((S)-2-((1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxo-1-(2,2,2-trifluoroacetamido)ethyl)adamantan-1-yl 2,2,2-trifluoroacetate
![3-((S)-2-((1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxo-1-(2,2,2-trifluoroacetamido)ethyl)adamantan-1-yl 2,2,2-trifluoroacetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-((S)-2-((1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxo-1-(2,2,2-trifluoroacetamido)ethyl)adamantan-1-yl 2,2,2-trifluoroacetate |
|---|---|
| IUPAC Name | 3-((S)-2-((1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl)-2-oxo-1-(2,2,2-trifluoroacetamido)ethyl)adamantan-1-yl 2,2,2-trifluoroacetate |
| Molecular Formula | C22H23F6N3O4 |
| Molecular Weight | 507.43 |
| SMILES | O=C(OC12CC3([C@H](NC(C(F)(F)F)=O)C(N4[C@@]5([H])C[C@@]5([H])C[C@H]4C#N)=O)CC(C2)CC(C3)C1)C(F)(F)F |
| InChI Key | JHYOJFWKXPRGIA-XZHPEASHSA-N |
| Synonym | Acetic acid, 2,2,2-trifluoro-, 3-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hex-2-yl]-2-oxo-1-[(2,2,2-trifluoroacetyl)amino]ethyl]tricyclo[3.3.1.13,7]dec-1-yl ester |
| CAS No. | 865999-68-4 |
Synthetic Route by SureRoute
2. ACYIUA167 Molecular Building Block Synthetic Route
N-((1S)-2-((1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hexan-2-yl)-1-(3-hydroxyadamantan-1-yl)-2-oxoethyl)-2,2,2-trifluoroacetamide
Boc-Saxagliptin
(1S,3S,5S)-2-((2S)-2-Amino-2-(3-hydroxyadamantan-1-yl)acetyl)-2-azabicyclo[3.1.0]hexane-3-carbonitrile