Vitas-M small molecule compound
2-[(4-benzylpiperazin-1-yl)methyl]-5-(3,3-dimethyl-2-oxobutoxy)-4H-pyran-4-one
Catalog ID
STK652109
SMILES O=C(C(C)(C)C)COc1coc(cc1=O)CN1CCN(CC1)Cc1ccccc1
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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 C23H30N2O4 MW 398.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O4/c1-23(2,3)22(27)17-29-21-16-28-19(13-20(21)26)15-25-11-9-24(10-12-25)14-18-7-5-4-6-8-18/h4-8,13,16H,9-12,14-15,17H2,1-3H3InChIKey
LYALESFSGPFWIH-UHFFFAOYSA-NSynonyms
1190296-72-01190296720
2((4benzylpiperazin1yl)methyl)5(33dimethyl2oxobutoxy)4Hpyran4one
2((4benzylpiperazin1yl)methyl)5(33dimethyl2oxobutoxy)pyran4one
CC(C)(C)C(=O)COC1=COC(=CC1=O)CN2CCN(CC2)CC3=CC=CC=C3
InChI=1SC23H30N2O4c123(23)22(27)172921162819(1320(21)26)152511924(101225)14187546818h481316H912141517H213H3
MFCD13759997
ZINC000036360909
ZINC36360909
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