F091-0525 Screening compound: 5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-1,3-thiazole-2,4-diamine

F091-0525 Screening compound: 5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-1,3-thiazole-2,4-diamine
F091-0525 Screening compound: 5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-1,3-thiazole-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound F091-0525
5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-1,3-thiazole-2,4-diamine

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

F091-0525

Molecular Formula

C19H18ClN3OS (C19 H18 ClN3 OS)

Compound Name

5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-1,3-thiazole-2,4-diamine

IUPAC name

5-(2-chlorobenzoyl)-N2-(2-ethyl-6-methylphenyl)-13-thiazole-24-diamine

SMILES

CCc(cccc1C)c1Nc1nc(N)c(C(c(cccc2)c2Cl)=O)s1

InChI

InChI=1S/C19H18ClN3OS/c1-3-12-8-6-7-11(2)15(12)22-19-23-18(21)17(25-19)16(24)13-9-4-5-10-14(13)20/h4-10H,3,21H2,1-2H3,(H,22,23)

InChI Key

GMMQNJGVEMMEBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14940733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.89

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.306

Distribution Coefficient, logD

5.306

Water Solubility, LogSw

-5.70

Polar Surface Area

51.965

Acid Dissociation Constant (pKa)

18.81

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

F091-0525 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F091-0525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F091-0525?
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What is the minimum amount of F091-0525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F091-0525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F091-0525
  • 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 F091-0525 available by request