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The chemical "1-{1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl}-3-(hydroxymethyl)-1,3-dihydro-2H-benzimidazol-2-one" is a complex organic compound with a molecular formula of C25H28FN3O3. It features a benzimidazolone core, which is a heterocyclic structure with a benzene ring fused to an imidazole ring. The compound has a 4-fluorophenyl group attached to a butyl chain, which is further connected to a piperidin-4-yl group. Additionally, it contains a hydroxymethyl group. This molecule is characterized by its fluorophenyl and butyl moieties, which contribute to its structural diversity and potential applications in medicinal chemistry, possibly as a precursor or intermediate in the synthesis of pharmaceuticals.

1814-13-7

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1814-13-7 Usage

Chemical structure

A complex chemical compound with a benzimidazol-2-one core, a piperidin-4-yl group, a fluoro-phenyl group, and a hydroxymethyl group.

Biological activity

Benzimidazole derivatives have been shown to exhibit a wide range of biological activities, including antimicrobial, anticancer, and antiviral properties.

Central nervous system agents

The piperidin-4-yl group may contribute to the compound's biological activity, as piperidine derivatives have been investigated for their potential as central nervous system agents.

Reactive group

The presence of the hydroxymethyl group could make 1-{1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl}-3-(hydroxymethyl)-1,3-dihydro-2H-benzimidazol-2-one suitable for use in medicinal chemistry, as it can act as a reactive group for further functionalization.

Pharmacological applications

The compound has the potential for various pharmacological applications and could be of interest for further research and development.

Molecular weight

399.45 g/mol

Appearance

The compound is likely to be a solid, based on its molecular weight and complexity.

Solubility

The compound's solubility is not explicitly mentioned, but it may be soluble in organic solvents such as dimethyl sulfoxide (DMSO) or methanol, given its lipophilic nature.

Stability

The stability of the compound is not explicitly mentioned, but it may be sensitive to light, heat, or moisture, as is common with many pharmaceutical compounds. Proper storage conditions should be maintained to preserve its integrity.

Check Digit Verification of cas no

The CAS Registry Mumber 1814-13-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,8,1 and 4 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 1814-13:
(6*1)+(5*8)+(4*1)+(3*4)+(2*1)+(1*3)=67
67 % 10 = 7
So 1814-13-7 is a valid CAS Registry Number.

1814-13-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one

1.2 Other means of identification

Product number -
Other names 1-{1-[4-(4-fluoro-phenyl)-4-oxo-butyl]-piperidin-4-yl}-3-hydroxymethyl-1,3-dihydro-benzoimidazol-2-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1814-13-7 SDS

1814-13-7Upstream product

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