Vitas-M small molecule compound

methyl 3-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]propanoate

Catalog ID
STK238581
SMILES COC(=O)CCn1nc(c2ccc(cc2)C)c2c(c1=O)cccc2

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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 C19H18N2O3 MW 322.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3/c1-13-7-9-14(10-8-13)18-15-5-3-4-6-16(15)19(23)21(20-18)12-11-17(22)24-2/h3-10H,11-12H2,1-2H3
InChIKey
BJGOFFUJMGOTPH-UHFFFAOYSA-N
Synonyms
694468-70-7
3(1OXO4PTOLYL1HPHTHALAZIN2YL)PROPIONICACIDMETHYLESTER
694468707
CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)OC
InChI=1SC19H18N2O3c1137914(10813)1815534616(15)19(23)21(2018)121117(22)242h310H1112H212H3
methyl3(1oxo4(ptolyl)phthalazin2(1H)yl)propanoate
methyl3(4(4methylphenyl)1oxophthalazin2(1H)yl)propanoate
METHYL3(4(4METHYLPHENYL)1OXOPHTHALAZIN2YL)PROPANOATE
MFCD04188677
ZINC000000543411
ZINC00543411
ZINC543411

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Available files

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