Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-6-benzyl-3-(4-chlorophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK584786
SMILES Clc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)Cc1ccccc1
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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 C23H19ClN2O3 MW 406.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN2O3/c24-14-8-6-13(7-9-14)20-19-15-10-16(21(19)29-25-20)18-17(15)22(27)26(23(18)28)11-12-4-2-1-3-5-12/h1-9,15-19,21H,10-11H2/t15-,16+,17+,18-,19+,21+/m0/s1InChIKey
UDFGQHIJBZHMKQ-WKOMVXTHSA-NSynonyms
1212198-97-4(3aR4R4aR7aS8R8aR)6benzyl3(4chlorophenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)6benzyl3(4chlorophenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1212198974
C1C2C3C(C1C4C2C(=NO4)C5=CC=C(C=C5)Cl)C(=O)N(C3=O)CC6=CC=CC=C6
Clc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)Cc1ccccc1
Clc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=O)N(C2=O)Cc1ccccc1
InChI=1SC23H19ClN2O3c24148613(7914)2019151016(21(19)292520)1817(15)22(27)26(23(18)28)11124213512h19151921H1011H2t1516+1718+1921m1s1
MFCD18245757
ZINC000005268322
Check stock
See real-time availability and sample size for STK584786 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.