Vitas-M small molecule compound

3,3'-[benzene-1,4-diylbis(oxy)]bis[1-(2-methyl-1H-benzimidazol-1-yl)propan-2-ol]

Catalog ID
STK954998
SMILES OC(Cn1c(C)nc2c1cccc2)COc1ccc(cc1)OCC(Cn1c(C)nc2c1cccc2)O

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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 C28H30N4O4 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4/c1-19-29-25-7-3-5-9-27(25)31(19)15-21(33)17-35-23-11-13-24(14-12-23)36-18-22(34)16-32-20(2)30-26-8-4-6-10-28(26)32/h3-14,21-22,33-34H,15-18H2,1-2H3
InChIKey
QIMMPMWCSKTYHY-UHFFFAOYSA-N
Synonyms
331870-16-7
1(4(2HYDROXY3(2METHYLBENZIMIDAZOL1YL)PROPOXY)PHENOXY)3(2METHYLBENZIMIDAZOL1YL)PROPAN2OL
3(4(2HYDROXY3(2METHYLBENZIMIDAZOLYL)PROPOXY)PHENOXY)1(2METHYLBENZIMIDAZOLYL)PROPAN2OL
33(benzene14diylbis(oxy))bis(1(2methyl1Hbenzimidazol1yl)propan2ol)
331870167
CC1=NC2=CC=CC=C2N1CC(COC3=CC=C(C=C3)OCC(CN4C(=NC5=CC=CC=C54)C)O)O
InChI=1SC28H30N4O4c1192925735927(25)31(19)1521(33)173523111324(141223)361822(34)163220(2)30268461028(26)32h31421223334H1518H212H3
MFCD01068011
ZINC000000898720
ZINC000016675577

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Available files

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