Vitas-M small molecule compound

3,3'-[sulfonylbis(benzene-4,1-diyloxy)]bis[1-(azepan-1-yl)propan-2-ol]

Catalog ID
STK536175
SMILES OC(CN1CCCCCC1)COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)OCC(CN1CCCCCC1)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 C30H44N2O6S MW 560.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H44N2O6S/c33-25(21-31-17-5-1-2-6-18-31)23-37-27-9-13-29(14-10-27)39(35,36)30-15-11-28(12-16-30)38-24-26(34)22-32-19-7-3-4-8-20-32/h9-16,25-26,33-34H,1-8,17-24H2
InChIKey
HDBJJWZSDLMCGS-UHFFFAOYSA-N
Synonyms

1(AZEPAN1YL)3(4(4(3(AZEPAN1YL)2HYDROXYPROPOXY)PHENYL)SULFONYLPHENOXY)PROPAN2OL
33((sulfonylbis(41phenylene))bis(oxy))bis(1(azepan1yl)propan2ol)
33(sulfonylbis(benzene41diyloxy))bis(1(azepan1yl)propan2ol)
4(3AZAPERHYDROEPINYL2HYDROXYPROPOXY)1((4(3AZAPERHYDROEPINYL2HYDROXYPROPOXY)PHENYL)SULFONYL)BENZENE
C1CCCN(CC1)CC(COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC(CN4CCCCCC4)O)O
InChI=1SC30H44N2O6Sc3325(21311751261831)23372791329(141027)39(3536)30151128(121630)382426(34)22321973482032h91625263334H181724H2
MFCD00652957
ZINC000097998441
ZINC000097998443

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Available files

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