Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-[1-(propan-2-yl)-1H-pyrazol-4-yl]propanoate
Catalog ID
STL491250
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1cnn(c1)C(C)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 C27H34N4O6 MW 510.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O6/c1-18(2)31-16-19(15-28-31)23(14-25(33)36-4)27-26(34)24(32)13-22(37-27)17-29-9-11-30(12-10-29)20-5-7-21(35-3)8-6-20/h5-8,13,15-16,18,23,34H,9-12,14,17H2,1-4H3InChIKey
WXVNEEYVUPFGBG-UHFFFAOYSA-NSynonyms
CC(C)N1C=C(C=N1)C(CC(=O)OC)C2=C(C(=O)C=C(O2)CN3CCN(CC3)C4=CC=C(C=C4)OC)O
InChI=1SC27H34N4O6c118(2)311619(152831)23(1425(33)364)2726(34)24(32)1322(3727)172991130(121029)205721(353)8620h58131516182334H9121417H214H3
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(1(propan2yl)1Hpyrazol4yl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(1isopropyl1Hpyrazol4yl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3(1propan2ylpyrazol4yl)propanoate
MFCD29057491
ZINC000253414261
ZINC000253414262
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Check stock on Vitas-MAvailable files
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