Vitas-M small molecule compound
(8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-10-[2-(trifluoromethyl)phenyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK551645
SMILES COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H20F3N3O4 MW 519.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20F3N3O4/c1-38-17-12-10-15(11-13-17)25(35)24-22-21(23-18-7-3-2-6-16(18)14-32-34(23)24)26(36)33(27(22)37)20-9-5-4-8-19(20)28(29,30)31/h2-14,21-24H,1H3/t21-,22+,23?,24-/m1/s1InChIKey
PNPHXNPBIFDSSI-MBDJBHLASA-NSynonyms
1014101-89-3(8R8aS11aR)8((4methoxyphenyl)carbonyl)10(2(trifluoromethyl)phenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8R8aS11aR)8(4methoxybenzoyl)10(2(trifluoromethyl)phenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1014101893
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=CC=C6C(F)(F)F
COc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3
InChI=1SC28H20F3N3O4c13817121015(111317)25(35)242221(2318732616(18)143234(23)24)26(36)33(27(22)37)20954819(20)28(2930)31h2142124H1H3t2122+23?24m1s1
MFCD18242598
ZINC000100965161
ZINC000100965168
Check stock
See real-time availability and sample size for STK551645 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.