Vitas-M small molecule compound

4-bromo-2-{[4-(4-ethylbenzyl)piperazin-1-yl]methyl}phenol

Catalog ID
STK145463
SMILES CCc1ccc(cc1)CN1CCN(CC1)Cc1cc(Br)ccc1O

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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 C20H25BrN2O MW 389.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN2O/c1-2-16-3-5-17(6-4-16)14-22-9-11-23(12-10-22)15-18-13-19(21)7-8-20(18)24/h3-8,13,24H,2,9-12,14-15H2,1H3
InChIKey
QCCRBCNJDNFMEM-UHFFFAOYSA-N
Synonyms

4BROMO2((4((4ETHYLPHENYL)METHYL)PIPERAZIN1YL)METHYL)PHENOL
4BROMO2((4(4ETHYLBENZYL)1PIPERAZINYL)METHYL)PHENOL
4BROMO2((4(4ETHYLBENZYL)PIPERAZIN1YL)METHYL)PHENOL
CCC1=CC=C(C=C1)CN2CCN(CC2)CC3=C(C=CC(=C3)Br)O
InChI=1SC20H25BrN2Oc12163517(6416)142291123(121022)15181319(21)7820(18)24h381324H29121415H21H3
MFCD02216371
ZINC000019361425
ZINC19361425

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Available files

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