Vitas-M small molecule compound

methyl 3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate

Catalog ID
STK529487
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)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 C23H25FN4O3 MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN4O3/c1-15-3-8-19-18(13-15)21(22(25-19)23(30)31-2)26-20(29)14-27-9-11-28(12-10-27)17-6-4-16(24)5-7-17/h3-8,13,25H,9-12,14H2,1-2H3,(H,26,29)
InChIKey
PLTWENXAZYDCEC-UHFFFAOYSA-N
Synonyms
371955-08-7
371955087
CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)F)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)C
InChI=1SC23H25FN4O3c115381918(1315)21(22(2519)23(30)312)2620(29)142791128(121027)176416(24)5717h381325H91214H212H3(H2629)
methyl3(((4(4fluorophenyl)piperazin1yl)acetyl)amino)5methyl1Hindole2carboxylate
METHYL3((2(4(4FLUOROPHENYL)PIPERAZIN1YL)ACETYL)AMINO)5METHYL1HINDOLE2CARBOXYLATE
methyl3(2(4(4fluorophenyl)piperazin1yl)acetamido)5methyl1Hindole2carboxylate
MFCD01857306
ZINC000057050836
ZINC57050836

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Available files

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