Vitas-M small molecule compound

1-[9-hydroxy-2-(2-methylpropyl)-10-[3-(pyridin-3-ylmethoxy)phenyl]-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone

Catalog ID
STL549871
SMILES CC(Cn1cc2c3c1cccc3N=C1C(=C(O)N(C1)C(=O)C)C2c1cccc(c1)OCc1cccnc1)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 C31H30N4O3 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3/c1-19(2)15-34-16-24-28(22-8-4-9-23(13-22)38-18-21-7-6-12-32-14-21)30-26(17-35(20(3)36)31(30)37)33-25-10-5-11-27(34)29(24)25/h4-14,16,19,28,37H,15,17-18H2,1-3H3
InChIKey
KPXHEKHVCQWYOB-UHFFFAOYSA-N
Synonyms

1(9hydroxy2(2methylpropyl)10(3(pyridin3ylmethoxy)phenyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC31H30N4O3c119(2)1534162428(2284923(1322)3818217612321421)3026(1735(20(3)36)31(30)37)33251051127(34)29(24)25h41416192837H151718H213H3
MFCD31757259
ZINC000888088664
ZINC000888088665

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.