Vitas-M small molecule compound
5-[4-(octyloxy)phenyl]-2-[4-(prop-2-en-1-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK740115
SMILES CCCCCCCCOc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)OCC=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 C33H38N2O3 MW 510.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38N2O3/c1-3-5-6-7-8-11-23-37-28-20-16-26(17-21-28)33-35-31(29-12-9-10-13-32(29)38-33)24-30(34-35)25-14-18-27(19-15-25)36-22-4-2/h4,9-10,12-21,31,33H,2-3,5-8,11,22-24H2,1H3InChIKey
MPSSQXCPLPZGCE-UHFFFAOYSA-NSynonyms
385418-42-81(6(4OCTYLOXYPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL))4PROP2ENYLOXYBENZENE
2(4(allyloxy)phenyl)5(4(octyloxy)phenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
385418428
5(4(octyloxy)phenyl)2(4(prop2en1yloxy)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
5(4OCTOXYPHENYL)2(4PROP2ENOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCCCCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OCC=C)C5=CC=CC=C5O2
InChI=1SC33H38N2O3c13567811233728201626(172128)333531(29129101332(29)3833)2430(3435)25141827(191525)362242h491012213133H2358112224H21H3
MFCD03286043
ZINC000097951418
ZINC000102690227
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