Vitas-M small molecule compound
4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrazol-3-yl]-6-propylbenzene-1,3-diol
Catalog ID
STK555754
SMILES CCCc1cc(c(cc1O)O)c1n[nH]cc1c1ccc2c(c1)OCCCO2
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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 C21H22N2O4 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4/c1-2-4-14-9-15(18(25)11-17(14)24)21-16(12-22-23-21)13-5-6-19-20(10-13)27-8-3-7-26-19/h5-6,9-12,24-25H,2-4,7-8H2,1H3,(H,22,23)InChIKey
BFBCHLVNXAHMHP-UHFFFAOYSA-NSynonyms
1009437-09-51009437095
4(4(34dihydro2H15benzodioxepin7yl)1Hpyrazol3yl)6propylbenzene13diol
4(4(34dihydro2Hbenzo(b)(14)dioxepin7yl)1Hpyrazol3yl)6propylbenzene13diol
CCCc1cc(c(cc1O)O)c1n(nH)cc1c1ccc2c(c1)OCCCO2
MFCD03861350
ZINC000018130553
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