Vitas-M small molecule compound
3-{[4-(3-chlorobenzyl)piperazin-1-yl]carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK474412
SMILES Clc1cccc(c1)CN1CCN(CC1)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 C20H25ClN2O3 MW 376.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O3/c21-16-3-1-2-13(10-16)12-22-6-8-23(9-7-22)19(24)17-14-4-5-15(11-14)18(17)20(25)26/h1-3,10,14-15,17-18H,4-9,11-12H2,(H,25,26)InChIKey
MOOIWKWMSIFBDR-UHFFFAOYSA-NSynonyms
2(4((3chlorophenyl)methyl)piperazine1carbonyl)bicyclo(221)heptane3carboxylicacid
3((4(3chlorobenzyl)piperazin1yl)carbonyl)bicyclo(221)heptane2carboxylicacid
C1CC2CC1C(C2C(=O)O)C(=O)N3CCN(CC3)CC4=CC(=CC=C4)Cl
InChI=1SC20H25ClN2O3c211631213(1016)12226823(9722)19(24)17144515(1114)18(17)20(25)26h131014151718H491112H2(H2526)
MFCD06063753
ZINC000102351688
ZINC000239159663
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