L604-0747 Screening compound: 3-(3-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,4-oxadiazol-2-yl}phenyl)-1-(3,4-dimethoxyphenyl)urea

L604-0747 Screening compound: 3-(3-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,4-oxadiazol-2-yl}phenyl)-1-(3,4-dimethoxyphenyl)urea
L604-0747 Screening compound: 3-(3-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,4-oxadiazol-2-yl}phenyl)-1-(3,4-dimethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L604-0747
3-(3-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,4-oxadiazol-2-yl}phenyl)-1-(3,4-dimethoxyphenyl)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

L604-0747

Molecular Formula

C25H22N4O6 (C25 H22 N4 O6)

Compound Name

3-(3-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3,4-oxadiazol-2-yl}phenyl)-1-(3,4-dimethoxyphenyl)urea

IUPAC name

3-(3-{5-[(2H-13-benzodioxol-5-yl)methyl]-134-oxadiazol-2-yl}phenyl)-1-(34-dimethoxyphenyl)urea

SMILES

COc(ccc(NC(Nc1cc(-c2nnc(Cc(cc3)cc4c3OCO4)o2)ccc1)=O)c1)c1OC

InChI

InChI=1S/C25H22N4O6/c1-31-19-9-7-18(13-21(19)32-2)27-25(30)26-17-5-3-4-16(12-17)24-29-28-23(35-24)11-15-6-8-20-22(10-15)34-14-33-20/h3-10,12-13H,11,14H2,1-2H3,(H2,26,27,30)

InChI Key

FKCXOKQDCHAPMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27464789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.535

Distribution Coefficient, logD

4.535

Water Solubility, LogSw

-4.45

Polar Surface Area

94.827

Acid Dissociation Constant (pKa)

12.41

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

L604-0747 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 L604-0747 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L604-0747?
Check Price and Availability of L604-0747, 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 L604-0747 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L604-0747
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L604-0747
  • 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 L604-0747 available by request