Account ASP-4000 HCl
- Catalog No. :
- ACSHCO739
- CAS No. :
- 851389-35-0
- Molecular Formula :
- C12H18ClN3O2
- Molecular Weight :
- 271.75
IUPAC Name:(S)-1-((1R,3S,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carbonyl)pyrrolidine-2-carbonitrile hydrochloride
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Product Information
| Product Name | ASP-4000 HCl |
|---|---|
| IUPAC Name | (S)-1-((1R,3S,4S,6R)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carbonyl)pyrrolidine-2-carbonitrile hydrochloride |
| Molecular Formula | C12H18ClN3O2 |
| Molecular Weight | 271.75 |
| SMILES | N#C[C@H]1N(C([C@H]2N[C@@]3([H])[C@H](O)C[C@]2([H])C3)=O)CCC1.[H]Cl |
| InChI Key | HBURXUXZLKNVTI-QSWPLQKNSA-N |
| Synonym | ASP-4000 hydrochoride;ASP 4000 HCl;ASP4000 HCl;ASP-4000 HCl;UNII-7393JFE67B |
| CAS No. | 851389-35-0 |
Synthetic Route by SureRoute
2. ACSHCO739 Molecular Building Block Synthetic Route
ASP-4000 free base
(1S,3S,5S)-2-((2S)-2-Amino-2-(3-hydroxyadamantan-1-yl)acetyl)-2-azabicyclo[3.1.0]hexane-3-carbonitrile hydrochloride dihydrate
(1S,3S,5S)-2-((2S)-2-Amino-2-(3-hydroxyadamantan-1-yl)acetyl)-2-azabicyclo[3.1.0]hexane-3-carbonitrile