Vitas-M small molecule compound

N,N'-bis(3,4-dihydro-1H-isochromen-1-ylmethyl)heptane-1,7-diamine

Catalog ID
STL546167
SMILES C(CCCNCC1OCCc2c1cccc2)CCCNCC1OCCc2c1cccc2

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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 C27H38N2O2 MW 422.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N2O2/c1(2-8-16-28-20-26-24-12-6-4-10-22(24)14-18-30-26)3-9-17-29-21-27-25-13-7-5-11-23(25)15-19-31-27/h4-7,10-13,26-29H,1-3,8-9,14-21H2
InChIKey
RLNGRBNBYVHQMZ-UHFFFAOYSA-N
Synonyms

~(N)~(N)bis(34dihydro1~(H)isochromen1ylmethyl)heptane17diamine
4587002
C(CCCNCC1OCCc2c1cccc2)CCCNCC1OCCc2c1cccc2II
InChI=1SC27H38N2O2c1(28162820262412641022(24)14183026)39172921272513751123(25)15193127h4710132629H13891421H2
MFCD01083246
N1N7bis(isochroman1ylmethyl)heptane17diaminedihydroiodide
NNbis(34dihydro1Hisochromen1ylmethyl)heptane17diamine
ZINC000002098887
ZINC000002098890

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.