Vitas-M small molecule compound

methyl 4-(4-acetylpiperazin-1-yl)-3-{[(4-chloro-3,5-dimethylphenoxy)acetyl]amino}benzoate

Catalog ID
STK195219
SMILES COC(=O)c1ccc(c(c1)NC(=O)COc1cc(C)c(c(c1)C)Cl)N1CCN(CC1)C(=O)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 C24H28ClN3O5 MW 473.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClN3O5/c1-15-11-19(12-16(2)23(15)25)33-14-22(30)26-20-13-18(24(31)32-4)5-6-21(20)28-9-7-27(8-10-28)17(3)29/h5-6,11-13H,7-10,14H2,1-4H3,(H,26,30)
InChIKey
PXIHSUFXARKIQG-UHFFFAOYSA-N
Synonyms

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C
InChI=1SC24H28ClN3O5c1151119(1216(2)23(15)25)331422(30)26201318(24(31)324)5621(20)289727(81028)17(3)29h561113H71014H214H3(H2630)
METHYL4(4ACETYLPIPERAZIN1YL)3(((4CHLORO35DIMETHYLPHENOXY)ACETYL)AMINO)BENZOATE
methyl4(4acetylpiperazin1yl)3((2(4chloro35dimethylphenoxy)acetyl)amino)benzoate
MFCD06665683
ZINC000009933649
ZINC09933649
ZINC9933649

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Available files

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