Vitas-M small molecule compound
3-(4-methoxyphenyl)-7-(2-oxo-2-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethoxy)-4H-chromen-4-one
Catalog ID
STK634877
SMILES COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CCN(CC1)CCc1ccncc1
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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 C29H29N3O5 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5/c1-35-23-4-2-22(3-5-23)26-19-37-27-18-24(6-7-25(27)29(26)34)36-20-28(33)32-16-14-31(15-17-32)13-10-21-8-11-30-12-9-21/h2-9,11-12,18-19H,10,13-17,20H2,1H3InChIKey
JLAUTQUXURDHEQ-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)7(2oxo2(4(2(pyridin4yl)ethyl)piperazin1yl)ethoxy)4Hchromen4one
3(4methoxyphenyl)7(2oxo2(4(2pyridin4ylethyl)piperazin1yl)ethoxy)chromen4one
COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)N4CCN(CC4)CCC5=CC=NC=C5
InChI=1SC29H29N3O5c135234222(3523)261937271824(6725(27)29(26)34)362028(33)32161431(151732)1310218113012921h2911121819H10131720H21H3
MFCD09854335
ZINC000013693753
ZINC13693753
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