F186-0462 Screening compound: N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-1,3-thiazol-2-yl)-4-methoxybenzamide

F186-0462 Screening compound: N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-1,3-thiazol-2-yl)-4-methoxybenzamide
F186-0462 Screening compound: N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-1,3-thiazol-2-yl)-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F186-0462
N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-1,3-thiazol-2-yl)-4-methoxybenzamide

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

F186-0462

Molecular Formula

C22H22N4O5S (C22 H22 N4 O5 S)

Compound Name

N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-1,3-thiazol-2-yl)-4-methoxybenzamide

IUPAC name

N-(4-{[(5-acetamido-2-methoxyphenyl)carbamoyl]methyl}-13-thiazol-2-yl)-4-methoxybenzamide

SMILES

CC(Nc(cc1)cc(NC(Cc2csc(NC(c(cc3)ccc3OC)=O)n2)=O)c1OC)=O

InChI

InChI=1S/C22H22N4O5S/c1-13(27)23-15-6-9-19(31-3)18(10-15)25-20(28)11-16-12-32-22(24-16)26-21(29)14-4-7-17(30-2)8-5-14/h4-10,12H,11H2,1-3H3,(H,23,27)(H,25,28)(H,24,26,29)

InChI Key

FDIGGFCKPUWKFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09009482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.679

Distribution Coefficient, logD

2.644

Water Solubility, LogSw

-3.23

Polar Surface Area

94.487

Acid Dissociation Constant (pKa)

8.48

Base Dissociation Constant (pKb)

0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

F186-0462 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F186-0462 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F186-0462?
Check Price and Availability of F186-0462, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F186-0462 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F186-0462
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F186-0462
  • 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 F186-0462 available by request