L399-0026 Screening compound: 1-(4-methylphenyl)-3-(4-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}phenyl)urea

L399-0026 Screening compound: 1-(4-methylphenyl)-3-(4-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}phenyl)urea
L399-0026 Screening compound: 1-(4-methylphenyl)-3-(4-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}phenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L399-0026
1-(4-methylphenyl)-3-(4-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}phenyl)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

L399-0026

Molecular Formula

C23H20N4O2S (C23 H20 N4 O2 S)

Compound Name

1-(4-methylphenyl)-3-(4-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}phenyl)urea

IUPAC name

1-(4-methylphenyl)-3-(4-{[(5-phenyl-134-oxadiazol-2-yl)methyl]sulfanyl}phenyl)urea

SMILES

Cc(cc1)ccc1NC(Nc(cc1)ccc1SCc1nnc(-c2ccccc2)o1)=O

InChI

InChI=1S/C23H20N4O2S/c1-16-7-9-18(10-8-16)24-23(28)25-19-11-13-20(14-12-19)30-15-21-26-27-22(29-21)17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H2,24,25,28)

InChI Key

XAPGYEQOVPYMNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15126016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.601

Distribution Coefficient, logD

5.601

Water Solubility, LogSw

-5.49

Polar Surface Area

62.451

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

L399-0026 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L399-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L399-0026?
Check Price and Availability of L399-0026, 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 L399-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L399-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L399-0026
  • 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 L399-0026 available by request