Vitas-M small molecule compound
[4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl](3-fluorophenyl)methanone
Catalog ID
STK052340
SMILES COc1cc(CCNc2cc(ccc2[N+](=O)[O-])N2CCN(CC2)C(=O)c2cccc(c2)F)ccc1OC
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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 C27H29FN4O5 MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN4O5/c1-36-25-9-6-19(16-26(25)37-2)10-11-29-23-18-22(7-8-24(23)32(34)35)30-12-14-31(15-13-30)27(33)20-4-3-5-21(28)17-20/h3-9,16-18,29H,10-15H2,1-2H3InChIKey
OCPJWLIIMOOVGL-UHFFFAOYSA-NSynonyms
(4(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)(3FLUOROPHENYL)METHANONE
(4(3((34dimethoxyphenethyl)amino)4nitrophenyl)piperazin1yl)(3fluorophenyl)methanone
(4(3(2(34DIMETHOXYPHENYL)ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(3FLUOROPHENYL)METHANONE
COC1=C(C=C(C=C1)CCNC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)(N+)(=O)(O))OC
COc1cc(CCNc2cc(ccc2(N+)(=O)(O))N2CCN(CC2)C(=O)c2cccc(c2)F)ccc1OC
InChI=1SC27H29FN4O5c136259619(1626(25)372)101129231822(7824(23)32(34)35)30121431(151330)27(33)2043521(28)1720h39161829H1015H212H3
MFCD02625919
STK052340
ZINC000008818231
ZINC08818231
ZINC8818231
Check stock
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Check stock on Vitas-MAvailable files
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