Vitas-M small molecule compound
[2-(3,4-dimethoxyphenyl)quinolin-4-yl]{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methanone
Catalog ID
STK417962
SMILES COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C31H31N3O3 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O3/c1-36-29-15-14-24(21-30(29)37-2)28-22-26(25-12-6-7-13-27(25)32-28)31(35)34-19-17-33(18-20-34)16-8-11-23-9-4-3-5-10-23/h3-15,21-22H,16-20H2,1-2H3/b11-8+InChIKey
CERIVCWWZWMDNK-DHZHZOJOSA-NSynonyms
352699-94-6(2(34dimethoxyphenyl)quinolin4yl)(4((2E)3phenylprop2en1yl)piperazin1yl)methanone
(2(34DIMETHOXYPHENYL)QUINOLIN4YL)(4((E)3PHENYLPROP2ENYL)PIPERAZIN1YL)METHANONE
352699946
COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)CC=CC5=CC=CC=C5)OC
COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)N1CCN(CC1)CC=Cc1ccccc1
InChI=1SC31H31N3O3c13629151424(2130(29)372)282226(2512671327(25)3228)31(35)34191733(182034)168112394351023h3152122H1620H212H3b118+
MFCD01920056
ZINC000020149503
ZINC20149503
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