Vitas-M small molecule compound

dimethyl {5-[(1,3-benzodioxol-5-ylmethyl)amino]-2-(4-methoxyphenyl)-1,3-oxazol-4-yl}phosphonate

Catalog ID
STK516782
SMILES COc1ccc(cc1)c1oc(c(n1)P(=O)(OC)OC)NCc1ccc2c(c1)OCO2

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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 C20H21N2O7P MW 432.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N2O7P/c1-24-15-7-5-14(6-8-15)18-22-20(30(23,25-2)26-3)19(29-18)21-11-13-4-9-16-17(10-13)28-12-27-16/h4-10,21H,11-12H2,1-3H3
InChIKey
JMADWZDXKUBRME-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC4=C(C=C3)OCO4)P(=O)(OC)OC
dimethyl(5((13benzodioxol5ylmethyl)amino)2(4methoxyphenyl)13oxazol4yl)phosphonate
InChI=1SC20H21N2O7Pc124157514(6815)182220(30(23252)263)19(2918)211113491617(1013)28122716h41021H1112H213H3
MFCD08548726
N(13benzodioxol5ylmethyl)4dimethoxyphosphoryl2(4methoxyphenyl)13oxazol5amine
ZINC000012062620
ZINC12062620

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Available files

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