L604-0047 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]urea

L604-0047 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]urea
L604-0047 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L604-0047
1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)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

L604-0047

Molecular Formula

C22H17BrN4O2 (C22 H17 BrN4 O2)

Compound Name

1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]urea

IUPAC name

1-(4-bromo-3-methylphenyl)-3-[3-(5-phenyl-134-oxadiazol-2-yl)phenyl]urea

SMILES

Cc(cc(cc1)NC(Nc2cc(-c3nnc(-c4ccccc4)o3)ccc2)=O)c1Br

InChI

InChI=1S/C22H17BrN4O2/c1-14-12-18(10-11-19(14)23)25-22(28)24-17-9-5-8-16(13-17)21-27-26-20(29-21)15-6-3-2-4-7-15/h2-13H,1H3,(H2,24,25,28)

InChI Key

KBUNJBGSRPLRAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27464765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.235

Distribution Coefficient, logD

6.235

Water Solubility, LogSw

-5.56

Polar Surface Area

62.786

Acid Dissociation Constant (pKa)

12.10

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

L604-0047 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L604-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L604-0047?
Check Price and Availability of L604-0047, 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 L604-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L604-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L604-0047
  • 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 L604-0047 available by request