Vitas-M small molecule compound

(2E)-1-(4-methylphenyl)-3-{1-[(4-methylpiperazin-1-yl)methyl]-1H-indol-3-yl}prop-2-en-1-one

Catalog ID
STK792795
SMILES CN1CCN(CC1)Cn1cc(c2c1cccc2)/C=C/C(=O)c1ccc(cc1)C

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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 C24H27N3O MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O/c1-19-7-9-20(10-8-19)24(28)12-11-21-17-27(23-6-4-3-5-22(21)23)18-26-15-13-25(2)14-16-26/h3-12,17H,13-16,18H2,1-2H3/b12-11+
InChIKey
MYEKQJSGTSNJHK-VAWYXSNFSA-N
Synonyms
1164533-83-8
(2E)1(4methylphenyl)3(1((4methylpiperazin1yl)methyl)1Hindol3yl)prop2en1one
(E)1(4METHYLPHENYL)3(1((4METHYLPIPERAZIN1YL)METHYL)INDOL3YL)PROP2EN1ONE
(E)3(1((4methylpiperazin1yl)methyl)1Hindol3yl)1(ptolyl)prop2en1one
(E)3(1(4METHYLPIPERAZIN1YLMETHYL)1HINDOL3YL)1PTOLYLPROPENONE
1164533838
CC1=CC=C(C=C1)C(=O)C=CC2=CN(C3=CC=CC=C32)CN4CCN(CC4)C
CN1CCN(CC1)Cn1cc(c2c1cccc2)C=CC(=O)c1ccc(cc1)C
InChI=1SC24H27N3Oc1197920(10819)24(28)1211211727(23643522(21)23)1826151325(2)141626h31217H131618H212H3b1211+
MFCD06610485
ZINC000020533392
ZINC20533392

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Available files

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