Vitas-M small molecule compound
1-(4-{3-[(2,2-dimethylpropyl)amino]-4-nitrophenyl}piperazin-1-yl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Catalog ID
STK172054
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)NCC(C)(C)C)[N+](=O)[O-])CC12CC3CC(C2)CC(C1)C3
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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 C27H40N4O3 MW 468.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N4O3/c1-26(2,3)18-28-23-13-22(4-5-24(23)31(33)34)29-6-8-30(9-7-29)25(32)17-27-14-19-10-20(15-27)12-21(11-19)16-27/h4-5,13,19-21,28H,6-12,14-18H2,1-3H3InChIKey
KKBUJMRIUNHIII-UHFFFAOYSA-NSynonyms
1(4(3((22dimethylpropyl)amino)4nitrophenyl)piperazin1yl)2(tricyclo(3311~37~)dec1yl)ethanone
2(1ADAMANTYL)1(4(3(22DIMETHYLPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2ADAMANTANYL1(4(3((22DIMETHYLPROPYL)AMINO)4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
CC(C)(C)CNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4)(N+)(=O)(O)
InChI=1SC27H40N4O3c126(23)1828231322(4524(23)31(33)34)296830(9729)25(32)172714191020(1527)1221(1119)1627h4513192128H6121418H213H3
MFCD05661687
O=C(N1CCN(CC1)c1ccc(c(c1)NCC(C)(C)C)(N+)(=O)(O))CC12CC3CC(C2)CC(C1)C3
ZINC000004125131
ZINC04125131
ZINC4125131
Check stock
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Check stock on Vitas-MAvailable files
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