Vitas-M small molecule compound

3-[4-(butanoyloxy)phenyl]-5-propyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl butanoate

Catalog ID
STK991238
SMILES CCCC(=O)Oc1ccc(cc1)n1cc(c2c1nc(CCC)n1c2nc2c1cccc2)OC(=O)CCC

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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 C29H30N4O4 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O4/c1-4-9-24-31-28-27(29-30-21-12-7-8-13-22(21)33(24)29)23(37-26(35)11-6-3)18-32(28)19-14-16-20(17-15-19)36-25(34)10-5-2/h7-8,12-18H,4-6,9-11H2,1-3H3
InChIKey
ULCPITMJPMIONC-UHFFFAOYSA-N
Synonyms
885203-84-9
3(4(butanoyloxy)phenyl)5propyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylbutanoate
4(1(butyryloxy)5propyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin3yl)phenylbutyrate
885203849
CCCC1=NC2=C(C(=CN2C3=CC=C(C=C3)OC(=O)CCC)OC(=O)CCC)C4=NC5=CC=CC=C5N14
InChI=1SC29H30N4O4c14924312827(29302112781322(21)33(24)29)23(3726(35)1163)1832(28)19141620(171519)3625(34)1052h781218H46911H213H3
MFCD06593710
ZINC000009242783
ZINC09242783
ZINC9242783

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Available files

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