Dolutegravir Impurity 49

cas: 1863916-87-3 — see every product listed under this CAS number, including other names

Dolutegravir Impurity 49 (CAS 1863916-87-3) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-D122049
cas1863916-87-3
sizeon request
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Structural formula: {0} (CAS {1})

(3S,7R)-N-[(2-fluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide (CAS 1863916-87-3) is a chemical compound with the molecular formula C20H20FN3O5 and a molecular weight of 401.4 g/mol. IUPAC name: (3S,7R)-N-[(2-fluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide. InChIKey: XBOHLWYCZARIPT-ABAIWWIYSA-N.

Identity
Molecular formulaC20H20FN3O5
Molecular weight401.4 g/mol
IUPAC name(3S,7R)-N-[(2-fluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide
InChIKeyXBOHLWYCZARIPT-ABAIWWIYSA-N
SMILESC[C@@H]1CCO[C@@H]2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=CC=CC=C4F)O

Computed by PubChem (NCBI)

Synonyms: 4-Defluoro dolutegravir, 2-Fluoro dolutegravir, Dolutegravir 4-desfluoro impurity, Dolutegravir Impurity 9, Dolutegravir Impurity D
Isomers (same molecular formula)
(3S,7R)-N-[(4-fluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide C20H20FN3O5

Also listed as

Dolutegravir Impurity 5 Chemat Brand CAS 1863916-87-3
Dolutegravir Impurity 2 Hubei YoungXin CAS 1863916-87-3
4-Defluoro Dolutegravir TRC CAS 1863916-87-3