Vitas-M small molecule compound
(3-fluorophenyl)[(3bS,4aR)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl]methanone
Catalog ID
STL563485
SMILES Fc1cccc(c1)C(=O)n1nc(c2c1C[C@@H]1[C@H]2C1(C)C)C
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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 C17H17FN2O MW 284.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN2O/c1-9-14-13(8-12-15(14)17(12,2)3)20(19-9)16(21)10-5-4-6-11(18)7-10/h4-7,12,15H,8H2,1-3H3/t12-,15-/m1/s1InChIKey
VPLMVAUUZRHSRT-IUODEOHRSA-NSynonyms
1212144-80-3(3fluorophenyl)((2S4R)339trimethyl78diazatricyclo(430024)nona1(6)8dien7yl)methanone
(3fluorophenyl)((3bS4aR)344trimethyl3b44a5tetrahydro1Hcyclopropa(34)cyclopenta(12c)pyrazol1yl)methanone
1212144803
932182
Fc1cccc(c1)C(=O)n1nc(c2c1C(C@@H)1(C@H)2C1(C)C)C
InChI=1SC17H17FN2Oc191413(81215(14)17(122)3)20(199)16(21)1054611(18)710h471215H8H213H3t1215m1s1
MFCD32651415
ZINC000000524486
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.