Vitas-M small molecule compound
(4bR,7aS,8R)-8-(phenylcarbonyl)-6-[2-(trifluoromethyl)phenyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK552602
SMILES O=C([C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)c1ccccc1
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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 C23H16F3N3O3 MW 439.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F3N3O3/c24-23(25,26)14-9-4-5-10-15(14)28-21(31)17-16-11-6-12-27-29(16)19(18(17)22(28)32)20(30)13-7-2-1-3-8-13/h1-12,16-19H/t16?,17-,18-,19+/m0/s1InChIKey
LJNQUWPKSZYGHB-HRVKUGKESA-NSynonyms
1014061-21-2(3aS4R9bR)4benzoyl2(2(trifluoromethyl)phenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4bR7aS8R)8(phenylcarbonyl)6(2(trifluoromethyl)phenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4bR7aS8R)8benzoyl6(2(trifluoromethyl)phenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1014061212
C1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC=C4)C(=O)N(C3=O)C5=CC=CC=C5C(F)(F)F
InChI=1SC23H16F3N3O3c2423(2526)149451015(14)2821(31)1716116122729(16)19(18(17)22(28)32)20(30)137213813h1121619Ht16?171819+m0s1
MFCD18242662
O=C((C@@H)1N2N=CC=CC2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccccc1C(F)(F)F)c1ccccc1
ZINC000016038599
ZINC000018128870
Check stock
See real-time availability and sample size for STK552602 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.