Account Sodium (3S,11aR)-8-((2,4-difluorobenzyl)carbamoyl)-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazin-6-olate
- Catalog No. :
- ACJUXI035
- CAS No. :
- 1051375-13-3
- Molecular Formula :
- C19H16F2N3NaO5
- Molecular Weight :
- 427.34
IUPAC Name:sodium (3S,11aR)-8-((2,4-difluorobenzyl)carbamoyl)-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazin-6-olate
![Sodium (3S,11aR)-8-((2,4-difluorobenzyl)carbamoyl)-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazin-6-olate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Sodium (3S,11aR)-8-((2,4-difluorobenzyl)carbamoyl)-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazin-6-olate |
|---|---|
| IUPAC Name | sodium (3S,11aR)-8-((2,4-difluorobenzyl)carbamoyl)-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazin-6-olate |
| Molecular Formula | C19H16F2N3NaO5 |
| Molecular Weight | 427.34 |
| SMILES | [H][C@@]12CN3C=C(C(NCC4=CC=C(C=C4F)F)=O)C(C([O-])=C3C(N1[C@@H](C)CO2)=O)=O.[Na+] |
| InChI Key | AEZBWGMXBKPGFP-KIUAEZIZSA-M |
| Synonym | Q27257476 | Cabotegravir (sodium) | CABOTEGRAVIR SODIUM [ORANGE BOOK] | EN300-97513 | F11513 | Tox21_111391 | Cabotegravir sodium | Oxazolo(3,2-a)pyrido(1,2-d)pyrazine-8-carboxamide, N-((2,4-difluorophenyl)methyl)-2,3,5,7,11,11a-hexahydro-6-hydroxy-3-meth |
| CAS No. | 1051375-13-3 |
| PubChem CID | 46215800 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H318-H410
- Precautionary Statement(s)
- P273-P280-P305+P351+P338-P501
Synthetic Route by SureRoute
2. ACJUXI035 Molecular Building Block Synthetic Route
(3S,11aR)-N-(2,4-Difluorobenzyl)-6-hydroxy-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazine-8-carboxamide
(3S,11aS)-N-(2,4-difluorobenzyl)-6-hydroxy-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazine-8-carboxamide
(3S,11AR)-N-(2,4-difluorobenzyl)-6-methoxy-3-methyl-5,7-dioxo-2,3,5,7,11,11a-hexahydrooxazolo[3,2-a]pyrido[1,2-d]pyrazine-8-carboxamide