Vitas-M small molecule compound

4-hydroxy-1,7-dimethyl-8-{2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethyl}-1H-imidazo[2,1-f]purin-2(8H)-one

Catalog ID
STK635106
SMILES Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCN1CCN(CC1)Cc1cccc2c1cccc2)C)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 C26H29N7O2 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N7O2/c1-18-16-33-22-23(29(2)26(35)28-24(22)34)27-25(33)32(18)15-14-30-10-12-31(13-11-30)17-20-8-5-7-19-6-3-4-9-21(19)20/h3-9,16H,10-15,17H2,1-2H3,(H,28,34,35)
InChIKey
BHGMXCCOFHJYOV-UHFFFAOYSA-N
Synonyms
923197-03-9
17DIMETHYL8(2(4(NAPHTHYLMETHYL)PIPERAZINYL)ETHYL)135TRIHYDRO4IMIDAZOLINO(12H)PURINE24DIONE
47dimethyl6(2(4(naphthalen1ylmethyl)piperazin1yl)ethyl)purino(78a)imidazole13dione
4hydroxy17dimethyl8(2(4(naphthalen1ylmethyl)piperazin1yl)ethyl)1Himidazo(21f)purin2(8H)one
923197039
CC1=CN2C3=C(N=C2N1CCN4CCN(CC4)CC5=CC=CC6=CC=CC=C65)N(C(=O)NC3=O)C
InChI=1SC26H29N7O2c11816332223(29(2)26(35)2824(22)34)2725(33)32(18)151430101231(131130)172085719634921(19)20h3916H101517H212H3(H283435)
MFCD18160615
ZINC000020675310
ZINC20675310

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Available files

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