Vitas-M small molecule compound
2,4-bis(azepan-1-ylmethyl)-1,5-bis(4-methoxyphenyl)pentane-1,5-dione
Catalog ID
STK526363
SMILES COc1ccc(cc1)C(=O)C(CN1CCCCCC1)CC(C(=O)c1ccc(cc1)OC)CN1CCCCCC1
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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 C33H46N2O4 MW 534.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H46N2O4/c1-38-30-15-11-26(12-16-30)32(36)28(24-34-19-7-3-4-8-20-34)23-29(25-35-21-9-5-6-10-22-35)33(37)27-13-17-31(39-2)18-14-27/h11-18,28-29H,3-10,19-25H2,1-2H3InChIKey
BVUMFDFVOZVFKR-UHFFFAOYSA-NSynonyms
24bis(azepan1ylmethyl)15bis(4methoxyphenyl)pentane15dione
24bis(azepan1ylmethyl)15bis(4methoxyphenyl)pentane15dionedihydrochloride
COC1=CC=C(C=C1)C(=O)C(CC(CN2CCCCCC2)C(=O)C3=CC=C(C=C3)OC)CN4CCCCCC4
COc1ccc(cc1)C(=O)C(CN1CCCCCC1)CC(C(=O)c1ccc(cc1)OC)CN1CCCCCC1ClCl
InChI=1SC33H46N2O4c13830151126(121630)32(36)28(24341973482034)2329(253521956102235)33(37)27131731(392)181427h11182829H3101925H212H3
MFCD00699678
ZINC000008926062
ZINC000009067751
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