Vitas-M small molecule compound

methyl 3-({[4-(2,3-dimethylphenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate

Catalog ID
STK540458
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(c(c2)OC)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 C26H32N4O5 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O5/c1-16-7-6-8-20(17(16)2)30-11-9-29(10-12-30)15-23(31)28-24-18-13-21(33-3)22(34-4)14-19(18)27-25(24)26(32)35-5/h6-8,13-14,27H,9-12,15H2,1-5H3,(H,28,31)
InChIKey
KDFNJPVVZVUYOA-UHFFFAOYSA-N
Synonyms

CC1=C(C(=CC=C1)N2CCN(CC2)CC(=O)NC3=C(NC4=CC(=C(C=C43)OC)OC)C(=O)OC)C
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(c(c2)OC)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(c(c2)OC)OCCl
InChI=1SC26H32N4O5c11676820(17(16)2)3011929(101230)1523(31)2824181321(333)22(344)1419(18)2725(24)26(32)355h68131427H91215H215H3(H2831)
methyl3(((4(23dimethylphenyl)piperazin1yl)acetyl)amino)56dimethoxy1Hindole2carboxylate
METHYL3((2(4(23DIMETHYLPHENYL)PIPERAZIN1YL)ACETYL)AMINO)56DIMETHOXY1HINDOLE2CARBOXYLATE
methyl3(2(4(23dimethylphenyl)piperazin1yl)acetamido)56dimethoxy1Hindole2carboxylatehydrochloride
MFCD03283947
ZINC000057058914
ZINC57058914

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Available files

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