Vitas-M small molecule compound

7-(4-fluorophenyl)-4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

Catalog ID
STK859446
SMILES Fc1ccc(cc1)n1cc(c2c1ncnc2N1CCN(C(C1)C)c1cccc(c1)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 C30H28FN5 MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN5/c1-21-7-6-10-26(17-21)35-16-15-34(18-22(35)2)29-28-27(23-8-4-3-5-9-23)19-36(30(28)33-20-32-29)25-13-11-24(31)12-14-25/h3-14,17,19-20,22H,15-16,18H2,1-2H3
InChIKey
PHSVFBPADRTADH-UHFFFAOYSA-N
Synonyms
477240-52-1
477240521
7(4fluorophenyl)4(3methyl4(3methylphenyl)piperazin1yl)5phenyl7Hpyrrolo(23d)pyrimidine
7(4FLUOROPHENYL)4(3METHYL4(3METHYLPHENYL)PIPERAZIN1YL)5PHENYLPYRROLO(23D)PYRIMIDINE
7(4FLUOROPHENYL)4(3METHYL4(MTOLYL)PIPERAZIN1YL)5PHENYL7HPYRROLO(23D)PYRIMIDINE
CC1CN(CCN1C2=CC=CC(=C2)C)C3=NC=NC4=C3C(=CN4C5=CC=C(C=C5)F)C6=CC=CC=C6
InChI=1SC30H28FN5c121761026(1721)35161534(1822(35)2)292827(238435923)1936(30(28)33203229)25131124(31)121425h31417192022H151618H212H3
MFCD04451051
ZINC000002714001
ZINC000016712750

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Available files

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