Vitas-M small molecule compound
(3-bromophenyl)[4-(4-nitro-3-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}phenyl)piperazin-1-yl]methanone
Catalog ID
STK150223
SMILES Brc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)[N+](=O)[O-]
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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 C29H35BrN4O3 MW 567.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35BrN4O3/c1-19(29-16-20-11-21(17-29)13-22(12-20)18-29)31-26-15-25(5-6-27(26)34(36)37)32-7-9-33(10-8-32)28(35)23-3-2-4-24(30)14-23/h2-6,14-15,19-22,31H,7-13,16-18H2,1H3InChIKey
WQANEFMAUXUJTE-UHFFFAOYSA-NSynonyms
(3bromophenyl)(4(4nitro3((1(tricyclo(3311~37~)dec1yl)ethyl)amino)phenyl)piperazin1yl)methanone
(4(3(1(1ADAMANTYL)ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(3BROMOPHENYL)METHANONE
Brc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)(N+)(=O)(O)
CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCN(CC5)C(=O)C6=CC(=CC=C6)Br)(N+)(=O)(O)
InChI=1SC29H35BrN4O3c119(2916201121(1729)1322(1220)1829)31261525(5627(26)34(36)37)327933(10832)28(35)2332424(30)1423h261415192231H7131618H21H3
MFCD03167104
ZINC000100134344
ZINC000100134346
Check stock
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Check stock on Vitas-MAvailable files
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