Vitas-M small molecule compound
2,3-dihydro-1,4-benzodioxin-6-yl{7-methyl-4-[(4-phenylpiperazin-1-yl)methyl]furo[2,3-c]pyridin-2-yl}methanone
Catalog ID
STL312445
SMILES O=C(c1oc2c(c1)c(cnc2C)CN1CCN(CC1)c1ccccc1)c1ccc2c(c1)OCCO2
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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 C28H27N3O4 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O4/c1-19-28-23(16-26(35-28)27(32)20-7-8-24-25(15-20)34-14-13-33-24)21(17-29-19)18-30-9-11-31(12-10-30)22-5-3-2-4-6-22/h2-8,15-17H,9-14,18H2,1H3InChIKey
IMGQTLUAEGGRHF-UHFFFAOYSA-NSynonyms
(23dihydrobenzo(b)(14)dioxin6yl)(7methyl4((4phenylpiperazin1yl)methyl)furo(23c)pyridin2yl)methanonehydrochloride
23dihydro14benzodioxin6yl(7methyl4((4phenylpiperazin1yl)methyl)furo(23c)pyridin2yl)methanone
CC1=NC=C(C2=C1OC(=C2)C(=O)C3=CC4=C(C=C3)OCCO4)CN5CCN(CC5)C6=CC=CC=C6
InChI=1SC28H27N3O4c1192823(1626(3528)27(32)20782425(1520)3414133324)21(172919)183091131(121030)225324622h281517H91418H21H3
MFCD28026660
O=C(c1oc2c(c1)c(cnc2C)CN1CCN(CC1)c1ccccc1)c1ccc2c(c1)OCCO2Cl
ZINC000095474798
ZINC95474798
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