Vitas-M small molecule compound

methyl 5-({4-[(2-fluorobenzyl)oxy]-3-methoxybenzyl}amino)-2-(morpholin-4-yl)benzoate

Catalog ID
STK188555
SMILES COC(=O)c1cc(NCc2ccc(c(c2)OC)OCc2ccccc2F)ccc1N1CCOCC1

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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 C27H29FN2O5 MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN2O5/c1-32-26-15-19(7-10-25(26)35-18-20-5-3-4-6-23(20)28)17-29-21-8-9-24(22(16-21)27(31)33-2)30-11-13-34-14-12-30/h3-10,15-16,29H,11-14,17-18H2,1-2H3
InChIKey
NLNCSOQAZXPICI-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC)OCC4=CC=CC=C4F
InChI=1SC27H29FN2O5c132261519(71025(26)351820534623(20)28)1729218924(22(1621)27(31)332)30111334141230h310151629H11141718H212H3
METHYL5((4((2FLUOROBENZYL)OXY)3METHOXYBENZYL)AMINO)2(MORPHOLIN4YL)BENZOATE
METHYL5((4((2FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOATE
MFCD06664660
ZINC000009907717
ZINC09907717
ZINC9907717

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.