Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-phenoxybutan-1-one

Catalog ID
STK052690
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CCCOc1ccccc1

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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 C22H26N2O4 MW 382.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4/c25-22(7-4-14-26-19-5-2-1-3-6-19)24-12-10-23(11-13-24)16-18-8-9-20-21(15-18)28-17-27-20/h1-3,5-6,8-9,15H,4,7,10-14,16-17H2
InChIKey
BVDBHZMWAAOOHF-UHFFFAOYSA-N
Synonyms
432533-50-1
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)4PHENOXYBUTAN1ONE
1(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)4PHENOXYBUTAN1ONE
1(4BENZO(13)DIOXOL5YLMETHYLPIPERAZIN1YL)4PHENOXYBUTAN1ONE
432533501
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCCOC4=CC=CC=C4
InChI=1SC22H26N2O4c2522(741426195213619)24121023(111324)1618892021(1518)28172720h13568915H4710141617H2
MFCD03119588
O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CCCOc1ccccc1
STK052690
ZINC000019953081
ZINC19953081

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Available files

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