Vitas-M small molecule compound

methyl 3-{[(2,5-dichlorophenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate

Catalog ID
STK188867
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1cc(Cl)ccc1Cl)N1CCN(CC1)C(=O)c1ccccc1

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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 C26H23Cl2N3O4 MW 512.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N3O4/c1-35-26(34)18-7-10-23(22(15-18)29-24(32)20-16-19(27)8-9-21(20)28)30-11-13-31(14-12-30)25(33)17-5-3-2-4-6-17/h2-10,15-16H,11-14H2,1H3,(H,29,32)
InChIKey
LLPUWMMQTJYLFZ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=C(C=CC(=C4)Cl)Cl
InChI=1SC26H23Cl2N3O4c13526(34)1871023(22(1518)2924(32)201619(27)8921(20)28)30111331(141230)25(33)175324617h2101516H1114H21H3(H2932)
METHYL3(((25DICHLOROPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
methyl4(4benzoylpiperazin1yl)3((25dichlorobenzoyl)amino)benzoate
MFCD06664961
ZINC000009907860
ZINC09907860
ZINC9907860

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Available files

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