Vitas-M small molecule compound

methyl 3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-6-methoxy-1H-indole-2-carboxylate

Catalog ID
STK553968
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)ccc(c2)OC

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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 C23H25FN4O4 MW 440.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN4O4/c1-31-17-7-8-18-19(13-17)25-22(23(30)32-2)21(18)26-20(29)14-27-9-11-28(12-10-27)16-5-3-15(24)4-6-16/h3-8,13,25H,9-12,14H2,1-2H3,(H,26,29)
InChIKey
NUFQAXMADQENHW-UHFFFAOYSA-N
Synonyms
840469-55-8
840469558
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)ccc(c2)OC
COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC23H25FN4O4c13117781819(1317)2522(23(30)322)21(18)2620(29)142791128(121027)165315(24)4616h381325H91214H212H3(H2629)
methyl3(((4(4fluorophenyl)piperazin1yl)acetyl)amino)6methoxy1Hindole2carboxylate
METHYL3((2(4(4FLUOROPHENYL)PIPERAZIN1YL)ACETYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
methyl3(2(4(4fluorophenyl)piperazin1yl)acetamido)6methoxy1Hindole2carboxylate
MFCD04005017
ZINC000057063872
ZINC57063872

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Available files

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