Vitas-M small molecule compound
2,5-bis(azepan-1-ylmethyl)-1,6-bis(4-propoxyphenyl)hexane-1,6-dione
Catalog ID
STK525468
SMILES CCCOc1ccc(cc1)C(=O)C(CN1CCCCCC1)CCC(C(=O)c1ccc(cc1)OCCC)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 C38H56N2O4 MW 604.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H56N2O4/c1-3-27-43-35-19-15-31(16-20-35)37(41)33(29-39-23-9-5-6-10-24-39)13-14-34(30-40-25-11-7-8-12-26-40)38(42)32-17-21-36(22-18-32)44-28-4-2/h15-22,33-34H,3-14,23-30H2,1-2H3InChIKey
BIIAQGUARVZTSC-UHFFFAOYSA-NSynonyms
25bis(azepan1ylmethyl)16bis(4propoxyphenyl)hexane16dione
25bis(azepan1ylmethyl)16bis(4propoxyphenyl)hexane16dionedihydrochloride
CCCOC1=CC=C(C=C1)C(=O)C(CCC(CN2CCCCCC2)C(=O)C3=CC=C(C=C3)OCCC)CN4CCCCCC4
CCCOc1ccc(cc1)C(=O)C(CN1CCCCCC1)CCC(C(=O)c1ccc(cc1)OCCC)CN1CCCCCC1ClCl
InChI=1SC38H56N2O4c13274335191531(162035)37(41)33(293923956102439)131434(3040251178122640)38(42)32172136(221832)442842h15223334H3142330H212H3
MFCD00699514
ZINC000102604307
ZINC000102604313
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