L534-0196 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide

L534-0196 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide
L534-0196 Screening compound: N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L534-0196
N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide

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

L534-0196

Molecular Formula

C24H17ClFN3O3 (C24 H17 ClFN3 O3)

Compound Name

N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-3-[6-(2-methoxyphenoxy)pyrimidin-4-yl]benzamide

SMILES

COc(cccc1)c1Oc1cc(-c2cccc(C(Nc(cc3)cc(Cl)c3F)=O)c2)ncn1

InChI

InChI=1S/C24H17ClFN3O3/c1-31-21-7-2-3-8-22(21)32-23-13-20(27-14-28-23)15-5-4-6-16(11-15)24(30)29-17-9-10-19(26)18(25)12-17/h2-14H,1H3,(H,29,30)

InChI Key

HLHWUJMEJDOVNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27460267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.520

Distribution Coefficient, logD

5.410

Water Solubility, LogSw

-6.02

Polar Surface Area

57.233

Acid Dissociation Constant (pKa)

7.94

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

L534-0196 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Immunological Library (6760 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with L534-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L534-0196?
Check Price and Availability of L534-0196, 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 L534-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L534-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L534-0196
  • 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 L534-0196 available by request