Account 3,6-diamino-9-(2-carboxy-4-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)phenyl)-5-sulfoxanthylium-4-sulfonate
- Catalog No. :
- ACQTQW859
- CAS No. :
- 1448221-35-9
- Molecular Formula :
- C44H41N13O12S2
- Molecular Weight :
- 1008.03
IUPAC Name:2-(3,6-diamino-4,5-disulfoxanthylium-9-yl)-5-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)benzoate
![3,6-diamino-9-(2-carboxy-4-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)phenyl)-5-sulfoxanthylium-4-sulfonate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3,6-diamino-9-(2-carboxy-4-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)phenyl)-5-sulfoxanthylium-4-sulfonate |
|---|---|
| IUPAC Name | 2-(3,6-diamino-4,5-disulfoxanthylium-9-yl)-5-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)benzoate |
| Molecular Formula | C44H41N13O12S2 |
| Molecular Weight | 1008.03 |
| SMILES | CN1C=C2C(=N1)N=C(NC(=O)CCCC1=CN(CCCCCCNC(=O)C3=CC(C(=O)[O-])=C(C4=C5C=CC(N)=C(S(=O)(=O)O)C5=[O+]C5=C4C=CC(N)=C5S(=O)(=O)O)C=C3)N=N1)N1N=C(C3=CC=CO3)N=C21 |
| InChI Key | BIUXUSNYNCIQBE-UHFFFAOYSA-N |
| CAS No. | 1448221-35-9 |
Synthetic Route by SureRoute
2. ACQTQW859 Molecular Building Block Synthetic Route
A2A/A3 AR antagonist-1 free
triethylamine hemi(2-(3,6-diamino-4-sulfo-5-sulfonatoxanthylium-9-yl)-5-((6-(4-(4-((2-(furan-2-yl)-8-methyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)amino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)hexyl)carbamoyl)benzoate)
A2A/A3 AR antagonist-1
![(R)-1-[(Sp)-2-(Dicyclohexylphosphino)ferrocenylethyl]diphenylphosphine structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/yq8i/158923-09-2.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260804%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260804T012022Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%22158923-09-2.png%22&x-id=GetObject&X-Amz-Signature=2f0c5a3165b731090c8c7d69d53412caa1fecc18ec87bcdd516d15145415ade2)