Vitas-M small molecule compound

methyl 3-{[3-(4-benzylpiperazin-1-yl)propanoyl]amino}-4-methoxy-1H-indole-2-carboxylate

Catalog ID
STL342425
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccccc1)c(OC)ccc2

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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 C25H30N4O4 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O4/c1-32-20-10-6-9-19-22(20)23(24(26-19)25(31)33-2)27-21(30)11-12-28-13-15-29(16-14-28)17-18-7-4-3-5-8-18/h3-10,26H,11-17H2,1-2H3,(H,27,30)
InChIKey
FBIJDPKKUDSORZ-UHFFFAOYSA-N
Synonyms
843638-71-1
843638711
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccccc1)c(OC)ccc2
COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)CC4=CC=CC=C4
InChI=1SC25H30N4O4c1322010691922(20)23(24(2619)25(31)332)2721(30)111228131529(161428)17187435818h31026H1117H212H3(H2730)
methyl3((3(4benzylpiperazin1yl)propanoyl)amino)4methoxy1Hindole2carboxylate
methyl3(3(4benzylpiperazin1yl)propanamido)4methoxy1Hindole2carboxylate
METHYL3(3(4BENZYLPIPERAZIN1YL)PROPANOYLAMINO)4METHOXY1HINDOLE2CARBOXYLATE
MFCD04154891
ZINC000022938417
ZINC22938417

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Available files

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