Vitas-M small molecule compound

3-(4-fluorophenyl)-5-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 3-methylbutanoate

Catalog ID
STK716205
SMILES CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)c1ccc(cc1)F)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 C27H27FN4O2 MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN4O2/c1-16(2)13-23-30-26-25(27-29-20-7-5-6-8-21(20)32(23)27)22(34-24(33)14-17(3)4)15-31(26)19-11-9-18(28)10-12-19/h5-12,15-17H,13-14H2,1-4H3
InChIKey
OPALJVABWRFBME-UHFFFAOYSA-N
Synonyms
885175-50-8
3(4fluorophenyl)5(2methylpropyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl3methylbutanoate
3(4fluorophenyl)5isobutyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl3methylbutanoate
885175508
CC(C)CC1=NC2=C(C(=CN2C3=CC=C(C=C3)F)OC(=O)CC(C)C)C4=NC5=CC=CC=C5N14
InChI=1SC27H27FN4O2c116(2)1323302625(272920756821(20)32(23)27)22(3424(33)1417(3)4)1531(26)1911918(28)101219h5121517H1314H214H3
MFCD06609723
ZINC000009124429
ZINC09124429
ZINC9124429

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Available files

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