Vitas-M small molecule compound
ethyl 1-benzyl-5-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropoxy]-2-methyl-1H-indole-3-carboxylate
Catalog ID
STK927752
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CN1CCN(CC1)Cc1ccccc1)O)cc2)Cc1ccccc1
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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 C33H39N3O4 MW 541.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O4/c1-3-39-33(38)32-25(2)36(22-27-12-8-5-9-13-27)31-15-14-29(20-30(31)32)40-24-28(37)23-35-18-16-34(17-19-35)21-26-10-6-4-7-11-26/h4-15,20,28,37H,3,16-19,21-24H2,1-2H3InChIKey
YYUUAXZMRDLMNI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)CC4=CC=CC=C4)O)CC5=CC=CC=C5)C
ethyl1benzyl5(3(4benzylpiperazin1yl)2hydroxypropoxy)2methyl1Hindole3carboxylate
ETHYL1BENZYL5(3(4BENZYLPIPERAZIN1YL)2HYDROXYPROPOXY)2METHYLINDOLE3CARBOXYLATE
ETHYL5(2HYDROXY3(4BENZYLPIPERAZINYL)PROPOXY)2METHYL1BENZYLINDOLE3CARBOXYLATE
InChI=1SC33H39N3O4c133933(38)3225(2)36(2227128591327)31151429(2030(31)32)402428(37)2335181634(171935)2126106471126h415202837H316192124H212H3
MFCD03130692
ZINC000028639398
ZINC000028639401
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