Vitas-M small molecule compound
7-hydroxy-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-1-(propan-2-yl)-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL521417
SMILES COc1cc(ccc1OCC(C)C)c1c2oc3c(c2nc2c1c(=O)[nH]n2C(C)C)ccc(c3)O
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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 C26H27N3O5 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5/c1-13(2)12-33-18-9-6-15(10-20(18)32-5)21-22-25(29(14(3)4)28-26(22)31)27-23-17-8-7-16(30)11-19(17)34-24(21)23/h6-11,13-14,30H,12H2,1-5H3,(H,28,31)InChIKey
XLUJIQRKXCNFTR-UHFFFAOYSA-NSynonyms
7hydroxy4(3methoxy4(2methylpropoxy)phenyl)1(propan2yl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
7hydroxy4(4isobutoxy3methoxyphenyl)1isopropyl1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
COc1cc(ccc1OCC(C)C)c1c2oc3c(c2nc2c1c(=O)(nH)n2C(C)C)ccc(c3)O
InChI=1SC26H27N3O5c113(2)1233189615(1020(18)325)212225(29(14(3)4)2826(22)31)2723178716(30)1119(17)3424(21)23h611131430H12H215H3(H2831)
MFCD22574760
ZINC000079194208
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