Vitas-M small molecule compound

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

Catalog ID
STK195086
SMILES COC(=O)c1cc(NCc2ccc(c(c2)OC)OCc2ccc(cc2)F)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/c1-32-26-15-20(5-10-25(26)35-18-19-3-6-21(28)7-4-19)17-29-22-8-9-24(23(16-22)27(31)33-2)30-11-13-34-14-12-30/h3-10,15-16,29H,11-14,17-18H2,1-2H3
InChIKey
OZGBUCPHGXGCQF-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC)OCC4=CC=C(C=C4)F
InChI=1SC27H29FN2O5c132261520(51025(26)3518193621(28)7419)1729228924(23(1622)27(31)332)30111334141230h310151629H11141718H212H3
METHYL5((4((4FLUOROBENZYL)OXY)3METHOXYBENZYL)AMINO)2(MORPHOLIN4YL)BENZOATE
METHYL5((4((4FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOATE
MFCD06665550
ZINC000009933552
ZINC09933552
ZINC9933552

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Available files

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