Vitas-M small molecule compound
1-{9-hydroxy-10-[7-methoxy-2-(piperidin-1-yl)quinolin-3-yl]-2-(propan-2-yl)-2,9,9a,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl}ethanone
Catalog ID
STL549092
SMILES COc1ccc2c(c1)nc(c(c2)C1C2C(=Nc3c4c1cn(c4ccc3)C(C)C)CN(C2O)C(=O)C)N1CCCCC1
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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 C33H37N5O3 MW 551.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H37N5O3/c1-19(2)37-17-24-29(31-27(18-38(20(3)39)33(31)40)34-25-9-8-10-28(37)30(24)25)23-15-21-11-12-22(41-4)16-26(21)35-32(23)36-13-6-5-7-14-36/h8-12,15-17,19,29,31,33,40H,5-7,13-14,18H2,1-4H3InChIKey
UXTYLUQGGCLGBH-UHFFFAOYSA-NSynonyms
1(6hydroxy8(7methoxy2piperidin1ylquinolin3yl)11propan2yl2511triazatetracyclo(7610^(37)0^(1216))hexadeca1(16)291214pentaen5yl)ethanone
1(9hydroxy10(7methoxy2(piperidin1yl)quinolin3yl)2(propan2yl)299a10tetrahydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
122170135
InChI=1SC33H37N5O3c119(2)37172429(3127(1838(20(3)39)33(31)40)3425981028(37)30(24)25)231521111222(414)1626(21)3532(23)36136571436h81215171929313340H57131418H214H3
MFCD31756867
ZINC000409414391
ZINC000409414398
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