Vitas-M small molecule compound
{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}(4-methoxyphenyl)methanone
Catalog ID
STK048197
SMILES COc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[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 C27H28N4O4 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4/c1-35-24-9-6-21(7-10-24)27(32)29-16-14-28(15-17-29)23-8-11-25(31(33)34)26(18-23)30-13-12-20-4-2-3-5-22(20)19-30/h2-11,18H,12-17,19H2,1H3InChIKey
DQFMVSCZEYYZGQ-UHFFFAOYSA-NSynonyms
(4(3(34DIHYDRO1HISOQUINOLIN2YL)4NITROPHENYL)PIPERAZIN1YL)(4METHOXYPHENYL)METHANONE
(4(3(34DIHYDROISOQUINOLIN2(1H)YL)4NITROPHENYL)PIPERAZIN1YL)(4METHOXYPHENYL)METHANONE
COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCC5=CC=CC=C5C4
COc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC27H28N4O4c135249621(71024)27(32)29161428(151729)2381125(31(33)34)26(1823)30131220423522(20)1930h21118H121719H21H3
MFCD03146473
STK048197
ZINC000009434488
ZINC09434488
ZINC9434488
Check stock
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Check stock on Vitas-MAvailable files
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