Vitas-M small molecule compound
7-[(2-chloro-6-fluorobenzyl)oxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-6-propyl-4H-chromen-4-one
Catalog ID
STK558015
SMILES CCCc1cc2c(cc1OCc1c(F)cccc1Cl)oc(c(c2=O)c1ccc2c(c1)OCCCO2)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 C29H26ClFO5 MW 508.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClFO5/c1-3-6-18-13-20-26(15-25(18)35-16-21-22(30)7-4-8-23(21)31)36-17(2)28(29(20)32)19-9-10-24-27(14-19)34-12-5-11-33-24/h4,7-10,13-15H,3,5-6,11-12,16H2,1-2H3InChIKey
WRNQVYQPUFOIIN-UHFFFAOYSA-NSynonyms
578701-08-33(2H3H4HBENZO(B)14DIOXEPAN7YL)7((2CHLORO6FLUOROPHENYL)METHOXY)2METHYL6PROPYLCHROMEN4ONE
578701083
7((2chloro6fluorobenzyl)oxy)3(34dihydro2H15benzodioxepin7yl)2methyl6propyl4Hchromen4one
7((2chloro6fluorobenzyl)oxy)3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl6propyl4Hchromen4one
7((2CHLORO6FLUOROPHENYL)METHOXY)3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL6PROPYLCHROMEN4ONE
CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=C(C=CC=C5Cl)F
InChI=1SC29H26ClFO5c13618132026(1525(18)35162122(30)74823(21)31)3617(2)28(29(20)32)199102427(1419)34125113324h47101315H356111216H212H3
MFCD04029347
ZINC000002387237
ZINC02387237
ZINC2387237
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