Products 3070953-78-2
CAS 3070953-78-2 is the registry number for STING-IN-14. Offered by: MedChemExpress. Available pack sizes: Get quote.
(21S,24S,27S)-N-benzyl-25-[1-(2,4-difluorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]-18,23-dioxo-15,28-dioxa-9,12,19,22,25,35-hexazahexacyclo[27.3.1.16,9.124,27.02,7.012,17]pentatriaconta-1(33),2,4,6(35),7,29,31-heptaene-21-carboxamide (CAS 3070953-78-2) is a chemical compound with the molecular formula C46H43F2N11O5 and a molecular weight of 867.9 g/mol. IUPAC name: (21S,24S,27S)-N-benzyl-25-[1-(2,4-difluorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]-18,23-dioxo-15,28-dioxa-9,12,19,22,25,35-hexazahexacyclo[27.3.1.16,9.124,27.02,7.012,17]pentatriaconta-1(33),2,4,6(35),7,29,31-heptaene-21-carboxamide. InChIKey: YXVADOXFIHTKJP-KYDASCHJSA-N.
| Molecular formula | C46H43F2N11O5 |
|---|---|
| Molecular weight | 867.9 g/mol |
| IUPAC name | (21S,24S,27S)-N-benzyl-25-[1-(2,4-difluorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]-18,23-dioxo-15,28-dioxa-9,12,19,22,25,35-hexazahexacyclo[27.3.1.16,9.124,27.02,7.012,17]pentatriaconta-1(33),2,4,6(35),7,29,31-heptaene-21-carboxamide |
| InChIKey | YXVADOXFIHTKJP-KYDASCHJSA-N |
| SMILES | C1CN2C=C3C(=N2)C=CC=C3C4=CC(=CC=C4)O[C@H]5C[C@@H](C(=O)N[C@@H](CNC(=O)C6N1CCOC6)C(=O)NCC7=CC=CC=C7)N(C5)C8=NC=NC9=C8C=NN9C1=C(C=C(C=C1)F)F |
Computed by PubChem (NCBI)
Synonyms:
orb3028377