Vitas-M small molecule compound

methyl N-(1,3-benzodioxol-5-ylcarbamoyl)-D-valinate

Catalog ID
STK581345
SMILES COC(=O)[C@@H](C(C)C)NC(=O)Nc1ccc2c(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 C14H18N2O5 MW 294.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O5/c1-8(2)12(13(17)19-3)16-14(18)15-9-4-5-10-11(6-9)21-7-20-10/h4-6,8,12H,7H2,1-3H3,(H2,15,16,18)/t12-/m1/s1
InChIKey
LDQNCWOQEYGFRT-GFCCVEGCSA-N
Synonyms
1173674-31-1
(R)methyl2(3(benzo(d)(13)dioxol5yl)ureido)3methylbutanoate
1173674311
CC(C)C(C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OCO2
COC(=O)(C@@H)(C(C)C)NC(=O)Nc1ccc2c(c1)OCO2
InChI=1SC14H18N2O5c18(2)12(13(17)193)1614(18)159451011(69)2172010h46812H7H213H3(H2151618)t12m1s1
METHYL(2R)2(13BENZODIOXOL5YLCARBAMOYLAMINO)3METHYLBUTANOATE
methylN(13benzodioxol5ylcarbamoyl)Dvalinate
MFCD07638449
ZINC000005355062
ZINC05355062
ZINC5355062

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Available files

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