L662-0823 Screening compound: 4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide

L662-0823 Screening compound: 4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
L662-0823 Screening compound: 4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L662-0823
4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}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

L662-0823

Molecular Formula

C26H23N3O2S (C26 H23 N3 O2 S)

Compound Name

4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide

IUPAC name

4-{[2-(4-methylphenyl)pyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide

SMILES

Cc(cc1)ccc1-c1nccc(Oc(cc2)ccc2C(NCc(cc2)ccc2SC)=O)n1

InChI

InChI=1S/C26H23N3O2S/c1-18-3-7-20(8-4-18)25-27-16-15-24(29-25)31-22-11-9-21(10-12-22)26(30)28-17-19-5-13-23(32-2)14-6-19/h3-16H,17H2,1-2H3,(H,28,30)

InChI Key

JUSDBQDELLLTHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27467803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.414

Distribution Coefficient, logD

5.414

Water Solubility, LogSw

-5.39

Polar Surface Area

50.032

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

L662-0823 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with L662-0823 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L662-0823?
Check Price and Availability of L662-0823, 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 L662-0823 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L662-0823
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L662-0823
  • 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 L662-0823 available by request