Vitas-M small molecule compound
3-chloro-2-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-1-benzoxepine
Catalog ID
STK874133
SMILES COc1ccc(cc1OC)C1=C(Cl)C=C(c2c(O1)cccc2)c1ccc(cc1)F
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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 C24H18ClFO3 MW 408.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClFO3/c1-27-22-12-9-16(13-23(22)28-2)24-20(25)14-19(15-7-10-17(26)11-8-15)18-5-3-4-6-21(18)29-24/h3-14H,1-2H3InChIKey
WBLYUMVVRCPEIY-UHFFFAOYSA-NSynonyms
676159-84-53chloro2(34dimethoxyphenyl)5(4fluorophenyl)1benzoxepine
3chloro2(34dimethoxyphenyl)5(4fluorophenyl)benzo(b)oxepine
676159845
COC1=C(C=C(C=C1)C2=C(C=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)F)Cl)OC
InChI=1SC24H18ClFO3c1272212916(1323(22)282)2420(25)1419(1571017(26)11815)18534621(18)2924h314H12H3
MFCD03828327
ZINC000002262708
ZINC02262708
ZINC2262708
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