Vitas-M small molecule compound
3-{[3-methyl-4-(4-methylphenyl)piperazin-1-yl]carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK463538
SMILES Cc1ccc(cc1)N1CCN(CC1C)C(=O)C1C2CCC(C1C(=O)O)C2
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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 C21H28N2O3 MW 356.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O3/c1-13-3-7-17(8-4-13)23-10-9-22(12-14(23)2)20(24)18-15-5-6-16(11-15)19(18)21(25)26/h3-4,7-8,14-16,18-19H,5-6,9-12H2,1-2H3,(H,25,26)InChIKey
ZCYMVDQSLCSQSO-UHFFFAOYSA-NSynonyms
2(3methyl4(4methylphenyl)piperazine1carbonyl)bicyclo(221)heptane3carboxylicacid
3((3methyl4(4methylphenyl)piperazin1yl)carbonyl)bicyclo(221)heptane2carboxylicacid
3((3METHYL4(4METHYLPHENYL)PIPERAZINYL)CARBONYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3C4CCC(C4)C3C(=O)O
InChI=1SC21H28N2O3c1133717(8413)2310922(1214(23)2)20(24)18155616(1115)19(18)21(25)26h347814161819H56912H212H3(H2526)
MFCD06066091
ZINC000239259383
ZINC000239259386
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