F042-0586 Screening compound: 2-(2-{[(3-chlorophenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]acetamide

F042-0586 Screening compound: 2-(2-{[(3-chlorophenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]acetamide
F042-0586 Screening compound: 2-(2-{[(3-chlorophenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F042-0586
2-(2-{[(3-chlorophenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]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

F042-0586

Molecular Formula

C19H16Cl2N4O2S (C19 H16 Cl2 N4 O2 S)

Compound Name

2-(2-{[(3-chlorophenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]acetamide

IUPAC name

2-(2-{[(3-chlorophenyl)carbamoyl]amino}-13-thiazol-4-yl)-N-[(4-chlorophenyl)methyl]acetamide

SMILES

O=C(Cc1csc(NC(Nc2cccc(Cl)c2)=O)n1)NCc(cc1)ccc1Cl

InChI

InChI=1S/C19H16Cl2N4O2S/c20-13-6-4-12(5-7-13)10-22-17(26)9-16-11-28-19(24-16)25-18(27)23-15-3-1-2-14(21)8-15/h1-8,11H,9-10H2,(H,22,26)(H2,23,24,25,27)

InChI Key

CDSUJUOGAQCNDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09240413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.238

Distribution Coefficient, logD

5.236

Water Solubility, LogSw

-5.66

Polar Surface Area

67.283

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

F042-0586 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F042-0586 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F042-0586?
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What is the minimum amount of F042-0586 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F042-0586
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F042-0586
  • 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 F042-0586 available by request