Vitas-M small molecule compound

2-[9-benzyl-4-(2-hydroxyphenyl)-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]-6-methoxyphenol

Catalog ID
STL200382
SMILES COc1cccc(c1O)C1CC(=NC2(N1)CCN(CC2)Cc1ccccc1)c1ccccc1O

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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 C28H31N3O3 MW 457.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O3/c1-34-26-13-7-11-22(27(26)33)24-18-23(21-10-5-6-12-25(21)32)29-28(30-24)14-16-31(17-15-28)19-20-8-3-2-4-9-20/h2-13,24,30,32-33H,14-19H2,1H3
InChIKey
RDQCPRYZNDFNKP-UHFFFAOYSA-N
Synonyms

2(9benzyl4(2hydroxyphenyl)159triazaspiro(55)undec4en2yl)6methoxyphenol
MFCD14731734
ZINC000032955223
ZINC000032955224

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Available files

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