4327-3025 Screening compound: 2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetamide

4327-3025 Screening compound: 2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetamide
4327-3025 Screening compound: 2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-3025
2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4327-3025

Molecular Formula

C18H19N3O2S (C18 H19 N3 O2 S)

Compound Name

2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-1,3-benzodiazol-1-yl)acetamide

IUPAC name

2-(2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-13-benzodiazol-1-yl)acetamide

SMILES

Cc1cccc(OCCSc2nc(cccc3)c3n2CC(N)=O)c1

InChI

InChI=1S/C18H19N3O2S/c1-13-5-4-6-14(11-13)23-9-10-24-18-20-15-7-2-3-8-16(15)21(18)12-17(19)22/h2-8,11H,9-10,12H2,1H3,(H2,19,22)

InChI Key

LOHSONKCPLSJEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01785200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.352

Distribution Coefficient, logD

3.352

Water Solubility, LogSw

-3.51

Polar Surface Area

51.555

Acid Dissociation Constant (pKa)

15.24

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

4327-3025 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4327-3025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-3025?
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What is the minimum amount of 4327-3025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-3025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-3025
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4327-3025 available by request