Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-9-chloro-5-(3,4,5-trimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL055526
SMILES COc1c(OC)cc(cc1OC)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc2c(c1)OCO2)Cl
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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 C26H23ClN2O6 MW 494.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O6/c1-30-23-9-15(10-24(31-2)25(23)32-3)26-29-19(17-11-16(27)5-7-20(17)35-26)12-18(28-29)14-4-6-21-22(8-14)34-13-33-21/h4-11,19,26H,12-13H2,1-3H3InChIKey
AWVQYEIOXUAAEM-UHFFFAOYSA-NSynonyms
845805-12-12(13benzodioxol5yl)9chloro5(345trimethoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2(13BENZODIOXOL5YL)9CHLORO5(345TRIMETHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
2(benzo(d)(13)dioxol5yl)9chloro5(345trimethoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
845805121
COC1=CC(=CC(=C1OC)OC)C2N3C(CC(=N3)C4=CC5=C(C=C4)OCO5)C6=C(O2)C=CC(=C6)Cl
InChI=1SC26H23ClN2O6c13023915(1024(312)25(23)323)262919(171116(27)5720(17)3526)1218(2829)14462122(814)34133321h4111926H1213H213H3
MFCD04170719
ZINC000009345302
ZINC000013811220
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