Vitas-M small molecule compound
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl 4-tert-butylbenzoate
Catalog ID
STK108877
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1)C(C)(C)C)C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C
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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 C27H30N4O5 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O5/c1-14-21(24(32)30-28-14)23(22-15(2)29-31-25(22)33)17-9-12-19(20(13-17)35-6)36-26(34)16-7-10-18(11-8-16)27(3,4)5/h7-13,23H,1-6H3,(H2,28,30,32)(H2,29,31,33)InChIKey
YDWUQAGXIUGHAK-UHFFFAOYSA-NSynonyms
432513-02-5(4(BIS(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)2METHOXYPHENYL)4TERTBUTYLBENZOATE
4(bis(5hydroxy3methyl1Hpyrazol4yl)methyl)2methoxyphenyl4(tertbutyl)benzoate
4(BIS(5HYDROXY3METHYL1HPYRAZOL4YL)METHYL)2METHOXYPHENYL4TERTBUTYLBENZOATE
4(BIS(5HYDROXY3METHYLPYRAZOL4YL)METHYL)2METHOXYPHENYL4(TERTBUTYL)BENZOATE
432513025
CC1=C(C(=O)NN1)C(C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)(C)C)OC)C4=C(NNC4=O)C
COc1cc(ccc1OC(=O)c1ccc(cc1)C(C)(C)C)C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
InChI=1SC27H30N4O5c11421(24(32)302814)23(2215(2)293125(22)33)1791219(20(1317)356)3626(34)1671018(11816)27(34)5h71323H16H3(H2283032)(H2293133)
MFCD03044108
ZINC000008934852
ZINC08934852
ZINC8934852
Check stock
See real-time availability and sample size for STK108877 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.