Vitas-M small molecule compound
[6-bromo-2-(2-methoxyphenyl)quinolin-4-yl][4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone
Catalog ID
STK481002
SMILES COc1ccccc1c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)Br
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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 C31H34BrN3O2 MW 560.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34BrN3O2/c1-37-29-5-3-2-4-24(29)28-16-26(25-15-23(32)6-7-27(25)33-28)30(36)34-8-10-35(11-9-34)31-17-20-12-21(18-31)14-22(13-20)19-31/h2-7,15-16,20-22H,8-14,17-19H2,1H3InChIKey
BVUXGCNZSOSTMJ-UHFFFAOYSA-NSynonyms
(4(1adamantyl)piperazin1yl)(6bromo2(2methoxyphenyl)quinolin4yl)methanone
(6bromo2(2methoxyphenyl)quinolin4yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
4ADAMANTANYLPIPERAZINYL6BROMO2(2METHOXYPHENYL)(4QUINOLYL)KETONE
COC1=CC=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C56CC7CC(C5)CC(C7)C6
InChI=1SC31H34BrN3O2c13729532424(29)281626(251523(32)6727(25)3328)30(36)3481035(11934)3117201221(1831)1422(1320)1931h2715162022H8141719H21H3
ZINC000098042738
ZINC98042738
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