Vitas-M small molecule compound

5,7-dihydroxy-6,8-bis{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-phenyl-4H-chromen-4-one

Catalog ID
STK888128
SMILES OCCN1CCN(CC1)Cc1c(O)c(CN2CCN(CC2)CCO)c2c(c1O)c(=O)cc(o2)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 C29H38N4O6 MW 538.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O6/c34-16-14-30-6-10-32(11-7-30)19-22-27(37)23(20-33-12-8-31(9-13-33)15-17-35)29-26(28(22)38)24(36)18-25(39-29)21-4-2-1-3-5-21/h1-5,18,34-35,37-38H,6-17,19-20H2
InChIKey
BLNYVUONFXTDPB-UHFFFAOYSA-N
Synonyms
384364-61-8
57dihydroxy68bis((4(2hydroxyethyl)piperazin1yl)methyl)2phenyl4Hchromen4one
57DIHYDROXY68BIS((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)2PHENYLCHROMEN4ONE
68BIS((4(2HYDROXYETHYL)PIPERAZIN1IUM1YL)METHYL)4OXO2PHENYLCHROMENE57DIOLATE
68BIS((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)57DIHYDROXY2PHENYLCHROMEN4ONE
C1CN(CCN1CCO)CC2=C(C3=C(C(=C2O)CN4CCN(CC4)CCO)OC(=CC3=O)C5=CC=CC=C5)O
InChI=1SC29H38N4O6c3416143061032(11730)192227(37)23(203312831(91333)151735)2926(28(22)38)24(36)1825(3929)214213521h151834353738H6171920H2
ZINC22854532

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Available files

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