Vitas-M small molecule compound
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[4-(propan-2-yl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL112530
SMILES CC(c1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc2c(c1)OCCO2)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 C27H26N2O3 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3/c1-17(2)18-7-9-19(10-8-18)27-29-23(21-5-3-4-6-24(21)32-27)16-22(28-29)20-11-12-25-26(15-20)31-14-13-30-25/h3-12,15,17,23,27H,13-14,16H2,1-2H3InChIKey
CZEAKZLYHQPZDX-UHFFFAOYSA-NSynonyms
2(23dihydro14benzodioxin6yl)5(4(propan2yl)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2(23DIHYDRO14BENZODIOXIN6YL)5(4PROPAN2YLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CC(C)C1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6O2
InChI=1SC27H26N2O3c117(2)187919(10818)272923(21534624(21)3227)1622(2829)2011122526(1520)3114133025h31215172327H131416H212H3
MFCD02711397
ZINC000012561642
ZINC000012561647
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