Vitas-M small molecule compound
(2E)-1-{4-[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-3-(3-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK875494
SMILES COc1cccc(c1)/C=C/C(=O)N1CCN(CC1)c1ncnc2c1c(cn2c1ccc(cc1)F)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 C32H28FN5O2 MW 533.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28FN5O2/c1-40-27-9-5-6-23(20-27)10-15-29(39)36-16-18-37(19-17-36)31-30-28(24-7-3-2-4-8-24)21-38(32(30)35-22-34-31)26-13-11-25(33)12-14-26/h2-15,20-22H,16-19H2,1H3/b15-10+InChIKey
XGHCFMCSRWABMP-XNTDXEJSSA-NSynonyms
(2E)1(4(7(4fluorophenyl)5phenyl7Hpyrrolo(23d)pyrimidin4yl)piperazin1yl)3(3methoxyphenyl)prop2en1one
(2E)1(4(7(4FLUOROPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YL)PIPERAZINYL)3(3METHOXYPHENYL)PROP2EN1ONE
(E)1(4(7(4fluorophenyl)5phenylpyrrolo(23d)pyrimidin4yl)piperazin1yl)3(3methoxyphenyl)prop2en1one
COC1=CC=CC(=C1)C=CC(=O)N2CCN(CC2)C3=NC=NC4=C3C(=CN4C5=CC=C(C=C5)F)C6=CC=CC=C6
COc1cccc(c1)C=CC(=O)N1CCN(CC1)c1ncnc2c1c(cn2c1ccc(cc1)F)c1ccccc1
InChI=1SC32H28FN5O2c1402795623(2027)101529(39)36161837(191736)313028(247324824)2138(32(30)35223431)26131125(33)121426h2152022H1619H21H3b1510+
MFCD09762756
ZINC000101215720
ZINC101215720
Check stock
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Check stock on Vitas-MAvailable files
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