F042-0018 Screening compound: 3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)-1-phenylurea

F042-0018 Screening compound: 3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)-1-phenylurea
F042-0018 Screening compound: 3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound F042-0018
3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)-1-phenylurea

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

F042-0018

Molecular Formula

C22H22FN5O2S (C22 H22 FN5 O2 S)

Compound Name

3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3-thiazol-2-yl)-1-phenylurea

IUPAC name

3-(4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-13-thiazol-2-yl)-1-phenylurea

SMILES

O=C(Cc1csc(NC(Nc2ccccc2)=O)n1)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C22H22FN5O2S/c23-16-6-8-19(9-7-16)27-10-12-28(13-11-27)20(29)14-18-15-31-22(25-18)26-21(30)24-17-4-2-1-3-5-17/h1-9,15H,10-14H2,(H2,24,25,26,30)

InChI Key

VFFZBYDBCOHUEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09240269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.130

Distribution Coefficient, logD

4.130

Water Solubility, LogSw

-4.18

Polar Surface Area

62.464

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

F042-0018 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • 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 F042-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F042-0018?
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What is the minimum amount of F042-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F042-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F042-0018
  • 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 F042-0018 available by request