Vitas-M small molecule compound
2,3-dihydro-1,4-benzodioxin-6-yl(7-methyl-4-{[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl}furo[2,3-c]pyridin-2-yl)methanone
Catalog ID
STL314433
SMILES O=C(c1oc2c(c1)c(cnc2C)CN1CCN(CC1)Cc1ccccn1)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 C28H28N4O4 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4/c1-19-28-23(15-26(36-28)27(33)20-5-6-24-25(14-20)35-13-12-34-24)21(16-30-19)17-31-8-10-32(11-9-31)18-22-4-2-3-7-29-22/h2-7,14-16H,8-13,17-18H2,1H3InChIKey
ZZNDQIUIFDBDEZ-UHFFFAOYSA-NSynonyms
(23dihydrobenzo(b)(14)dioxin6yl)(7methyl4((4(pyridin2ylmethyl)piperazin1yl)methyl)furo(23c)pyridin2yl)methanonedihydrochloride
23dihydro14benzodioxin6yl(7methyl4((4(pyridin2ylmethyl)piperazin1yl)methyl)furo(23c)pyridin2yl)methanone
CC1=NC=C(C2=C1OC(=C2)C(=O)C3=CC4=C(C=C3)OCCO4)CN5CCN(CC5)CC6=CC=CC=N6
InChI=1SC28H28N4O4c1192823(1526(3628)27(33)20562425(1420)3513123424)21(163019)173181032(11931)182242372922h271416H8131718H21H3
MFCD28030705
O=C(c1oc2c(c1)c(cnc2C)CN1CCN(CC1)Cc1ccccn1)c1ccc2c(c1)OCCO2ClCl
ZINC000095476320
ZINC95476320
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