Vitas-M small molecule compound
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL112529
SMILES COc1cccc(c1)C1Oc2ccccc2C2N1N=C(C2)c1ccc2c(c1)OCCO2
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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 C25H22N2O4 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4/c1-28-18-6-4-5-17(13-18)25-27-21(19-7-2-3-8-22(19)31-25)15-20(26-27)16-9-10-23-24(14-16)30-12-11-29-23/h2-10,13-14,21,25H,11-12,15H2,1H3InChIKey
GGTBYVSNLZCOEO-UHFFFAOYSA-NSynonyms
380341-05-92(23dihydro14benzodioxin6yl)5(3methoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2(23DIHYDRO14BENZODIOXIN6YL)5(3METHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
380341059
COC1=CC=CC(=C1)C2N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6O2
InChI=1SC25H22N2O4c1281864517(1318)252721(19723822(19)3125)1520(2627)169102324(1416)3012112923h21013142125H111215H21H3
MFCD03150248
ZINC000004931088
ZINC000012575922
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