Vitas-M small molecule compound

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

Catalog ID
STL343813
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)ccc(c2)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 C23H32N4O3 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O3/c1-16-8-9-18-19(14-16)24-22(23(29)30-2)21(18)25-20(28)15-26-10-12-27(13-11-26)17-6-4-3-5-7-17/h8-9,14,17,24H,3-7,10-13,15H2,1-2H3,(H,25,28)
InChIKey
UPPKYXOMLLZLLA-UHFFFAOYSA-N
Synonyms
845806-29-3
845806293
CC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C4CCCCC4
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)ccc(c2)C
InChI=1SC23H32N4O3c116891819(1416)2422(23(29)302)21(18)2520(28)1526101227(131126)176435717h89141724H37101315H212H3(H2528)
methyl3(((4cyclohexylpiperazin1yl)acetyl)amino)6methyl1Hindole2carboxylate
METHYL3((2(4CYCLOHEXYLPIPERAZIN1YL)ACETYL)AMINO)6METHYL1HINDOLE2CARBOXYLATE
methyl3(2(4cyclohexylpiperazin1yl)acetamido)6methyl1Hindole2carboxylate
MFCD04170174
ZINC000020391176
ZINC20391176

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Available files

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