Vitas-M small molecule compound

4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)-N-(4-methylphenyl)piperazine-1-carboxamide

Catalog ID
STK241204
SMILES Cc1ccc(cc1)NC(=O)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2

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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 C21H23N3O4 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4/c1-15-6-8-16(9-7-15)22-21(26)24-12-10-23(11-13-24)20(25)19-14-27-17-4-2-3-5-18(17)28-19/h2-9,19H,10-14H2,1H3,(H,22,26)
InChIKey
VMJRHYDFXPVXLK-UHFFFAOYSA-N
Synonyms

4(23dihydro14benzodioxin2ylcarbonyl)N(4methylphenyl)piperazine1carboxamide
4(23dihydro14benzodioxine3carbonyl)N(4methylphenyl)piperazine1carboxamide
CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3
InChI=1SC21H23N3O4c1156816(9715)2221(26)24121023(111324)20(25)19142717423518(17)2819h2919H1014H21H3(H2226)
MFCD07153403
ZINC000009226785
ZINC000009226786

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Available files

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