Vitas-M small molecule compound
1-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Catalog ID
STK854377
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)C12CCC(C2(C)C)(C(=O)O1)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 C20H25ClN2O3 MW 376.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O3/c1-18(2)19(3)7-8-20(18,26-17(19)25)16(24)23-11-9-22(10-12-23)15-6-4-5-14(21)13-15/h4-6,13H,7-12H2,1-3H3InChIKey
CORDAKZOWSMDDA-UHFFFAOYSA-NSynonyms
613658-58-5(1S4S)1(4(3chlorophenyl)piperazine1carbonyl)477trimethyl2oxabicyclo(221)heptan3one
1((4(3chlorophenyl)piperazin1yl)carbonyl)477trimethyl2oxabicyclo(221)heptan3one
4((4(3CHLOROPHENYL)PIPERAZINYL)CARBONYL)177TRIMETHYL3OXABICYCLO(221)HEPTAN2ONE
4(4(3CHLOROPHENYL)PIPERAZINE1CARBONYL)177TRIMETHYL3OXABICYCLO(221)HEPTAN2ONE
613658585
CC1(C2(CCC1(OC2=O)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C)C
InChI=1SC20H25ClN2O3c118(2)19(3)7820(182617(19)25)16(24)2311922(101223)1564514(21)1315h4613H712H213H3
MFCD06260887
ZINC000006386131
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