Vitas-M small molecule compound

3-(azepan-1-yl)-1-(4-butoxyphenyl)-2-phenylpropan-1-ol

Catalog ID
STL321642
SMILES CCCCOc1ccc(cc1)C(C(c1ccccc1)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 C25H35NO2 MW 381.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35NO2/c1-2-3-19-28-23-15-13-22(14-16-23)25(27)24(21-11-7-6-8-12-21)20-26-17-9-4-5-10-18-26/h6-8,11-16,24-25,27H,2-5,9-10,17-20H2,1H3
InChIKey
HHWZRJJAOKEIDL-UHFFFAOYSA-N
Synonyms

(1R2S)3(AZEPAN1YL)1(4BUTOXYPHENYL)2PHENYLPROPAN1OL
(1S2S)3(AZEPAN1YL)1(4BUTOXYPHENYL)2PHENYLPROPAN1OL
3(azepan1yl)1(4butoxyphenyl)2phenylpropan1ol
CCCCOC1=CC=C(C=C1)C(C(CN2CCCCCC2)C3=CC=CC=C3)O
InChI=1SC25H35NO2c123192823151322(141623)25(27)24(21117681221)202617945101826h681116242527H259101720H21H3
MFCD00699457
ZINC000001781637
ZINC000001781644

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Available files

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