Vitas-M small molecule compound

methyl {4-[4-(naphthalen-2-ylamino)phthalazin-1-yl]phenoxy}acetate

Catalog ID
STK200914
SMILES COC(=O)COc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc2c(c1)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 C27H21N3O3 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O3/c1-32-25(31)17-33-22-14-11-19(12-15-22)26-23-8-4-5-9-24(23)27(30-29-26)28-21-13-10-18-6-2-3-7-20(18)16-21/h2-16H,17H2,1H3,(H,28,30)
InChIKey
NTBHYEQQPGQROC-UHFFFAOYSA-N
Synonyms
487035-69-8
487035698
COC(=O)COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=CC=CC=C5C=C4
InChI=1SC27H21N3O3c13225(31)173322141119(121522)2623845924(23)27(302926)2821131018623720(18)1621h216H17H21H3(H2830)
methyl(4(4(naphthalen2ylamino)phthalazin1yl)phenoxy)acetate
METHYL2(4(4(NAPHTHALEN2YLAMINO)PHTHALAZIN1YL)PHENOXY)ACETATE
MFCD03287237
ZINC000002322412
ZINC02322412
ZINC2322412

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Available files

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