Vitas-M small molecule compound
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]-2-ethoxyphenyl 4-methylbenzoate
Catalog ID
STK013188
SMILES CCOc1cc(ccc1OC(=O)c1ccc(cc1)C)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O
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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 C25H26N4O5 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5/c1-5-33-19-12-17(10-11-18(19)34-25(32)16-8-6-13(2)7-9-16)22(20-14(3)26-28-23(20)30)21-15(4)27-29-24(21)31/h6-12,22H,5H2,1-4H3,(H2,26,28,30)(H2,27,29,31)InChIKey
CERJAVZPMYEQLQ-UHFFFAOYSA-NSynonyms
(4(BIS(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)2ETHOXYPHENYL)4METHYLBENZOATE
4(BIS(5HYDROXY3METHYL1HPYRAZOL4YL)METHYL)2ETHOXYPHENYL4METHYLBENZOATE
4(BIS(5HYDROXY3METHYLPYRAZOL4YL)METHYL)2ETHOXYPHENYL4METHYLBENZOATE
CCOC1=C(C=CC(=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C)OC(=O)C4=CC=C(C=C4)C
CCOc1cc(ccc1OC(=O)c1ccc(cc1)C)C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
InChI=1SC25H26N4O5c1533191217(101118(19)3425(32)168613(2)7916)22(2014(3)262823(20)30)2115(4)272924(21)31h61222H5H214H3(H2262830)(H2272931)
MFCD03043093
STK013188
ZINC000019907733
ZINC19907733
Check stock
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Check stock on Vitas-MAvailable files
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