2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol

Modify Date: 2025-09-19 15:04:11

2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol Structure
2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol structure
Common Name 2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol
CAS Number 116102-15-9 Molecular Weight 488.66700
Density N/A Boiling Point N/A
Molecular Formula C27H28N4OS2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol

 Chemical & Physical Properties

Molecular Formula C27H28N4OS2
Molecular Weight 488.66700
Exact Mass 488.17000
PSA 128.19000
LogP 6.40500
InChIKey FKWYUDDRIYFWJH-UHFFFAOYSA-N
SMILES Cc1cc(CSCCc2nc3ccccc3[nH]2)c(O)c(CSCCc2nc3ccccc3[nH]2)c1

 Synthetic Route

~25%

2,6-bis[2-(1H-benzimidazol-2-yl)ethylsulfanylmethyl]-4-methylphenol Structure

2,6-bis[2-(1H-b...

CAS#:116102-15-9

Literature: Benzekri, Azdine; Dubourdeux, Patrick; Latour, Jean-Marc; Rey, Paul; Laugier, Jean Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999), 1991 , # 12 p. 3359 - 3366

 Precursor & DownStream

Precursor  2

DownStream  0

 Bioassay

View more

Name: Inhibition of BChE (unknown origin) incubated for 10 mins by Ellman's method
Source: ChEMBL
Target: Cholinesterase
External Id: CHEMBL4410784
Name: Inhibition of AChE (unknown origin) at 5000 nM by Ellman's method
Source: ChEMBL
Target: Acetylcholinesterase
External Id: CHEMBL4410786
Name: Inhibition of BChE (unknown origin) at 5 uM incubated for 10 mins by Ellman's method ...
Source: ChEMBL
Target: Cholinesterase
External Id: CHEMBL4410787
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