Vitas-M small molecule compound
1'-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-3a,4,5,6,7,7a-hexahydrospiro[1,3-benzodioxole-2,3'-indol]-2'(1'H)-one
Catalog ID
STK780558
SMILES Fc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OC1C(O2)CCCC1
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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 C25H28FN3O3 MW 437.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28FN3O3/c26-18-9-11-19(12-10-18)28-15-13-27(14-16-28)17-29-21-6-2-1-5-20(21)25(24(29)30)31-22-7-3-4-8-23(22)32-25/h1-2,5-6,9-12,22-23H,3-4,7-8,13-17H2InChIKey
FRDSMIIZESQQME-UHFFFAOYSA-NSynonyms
1((4(4fluorophenyl)piperazin1yl)methyl)3a45677ahexahydrospiro(13benzodioxole23indol)2(1H)one
1((4(4fluorophenyl)piperazin1yl)methyl)spiro(3a45677ahexahydro13benzodioxole23indole)2one
C1CCC2C(C1)OC3(O2)C4=CC=CC=C4N(C3=O)CN5CCN(CC5)C6=CC=C(C=C6)F
InChI=1SC25H28FN3O3c261891119(121018)28151327(141628)172921621520(21)25(24(29)30)3122734823(22)3225h12569122223H34781317H2
MFCD06013320
ZINC000012377332
ZINC000252430696
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