8015-3122 Screening compound: 1-(3-fluorobenzoyl)-3-(2,4,6-trimethylpyridin-3-yl)urea

8015-3122 Screening compound: 1-(3-fluorobenzoyl)-3-(2,4,6-trimethylpyridin-3-yl)urea
8015-3122 Screening compound: 1-(3-fluorobenzoyl)-3-(2,4,6-trimethylpyridin-3-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-3122
1-(3-fluorobenzoyl)-3-(2,4,6-trimethylpyridin-3-yl)urea

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

8015-3122

Molecular Formula

C16H16FN3O2 (C16 H16 FN3 O2)

Compound Name

1-(3-fluorobenzoyl)-3-(2,4,6-trimethylpyridin-3-yl)urea

IUPAC name

1-(3-fluorobenzoyl)-3-(246-trimethylpyridin-3-yl)urea

SMILES

Cc1cc(C)nc(C)c1NC(NC(c1cccc(F)c1)=O)=O

InChI

InChI=1S/C16H16FN3O2/c1-9-7-10(2)18-11(3)14(9)19-16(22)20-15(21)12-5-4-6-13(17)8-12/h4-8H,1-3H3,(H2,19,20,21,22)

InChI Key

PTGQOHABDMGMEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.134

Distribution Coefficient, logD

1.450

Water Solubility, LogSw

-2.84

Polar Surface Area

54.324

Acid Dissociation Constant (pKa)

6.82

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8015-3122 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8015-3122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3122?
Check Price and Availability of 8015-3122, 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 8015-3122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3122
  • 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 8015-3122 available by request