Vitas-M small molecule compound

methyl 2-({[4-(4-methylbenzyl)piperazin-1-yl]carbonyl}amino)benzoate

Catalog ID
STK479316
SMILES COC(=O)c1ccccc1NC(=O)N1CCN(CC1)Cc1ccc(cc1)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 C21H25N3O3 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3/c1-16-7-9-17(10-8-16)15-23-11-13-24(14-12-23)21(26)22-19-6-4-3-5-18(19)20(25)27-2/h3-10H,11-15H2,1-2H3,(H,22,26)
InChIKey
GQGNJYHLZNXJQB-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC21H25N3O3c1167917(10816)1523111324(141223)21(26)2219643518(19)20(25)272h310H1115H212H3(H2226)
methyl2(((4(4methylbenzyl)piperazin1yl)carbonyl)amino)benzoate
METHYL2((4((4METHYLPHENYL)METHYL)PIPERAZINE1CARBONYL)AMINO)BENZOATE
METHYL2((4((4METHYLPHENYL)METHYL)PIPERAZINYL)CARBONYLAMINO)BENZOATE
MFCD04279798
ZINC000020367189
ZINC20367189

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Available files

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