L882-0239 Screening compound: ethyl 2-({2-[5-(4-fluorobenzyl)-4-oxo-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidin-2-yl]acetyl}amino)benzoate

L882-0239 Screening compound: ethyl 2-({2-[5-(4-fluorobenzyl)-4-oxo-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidin-2-yl]acetyl}amino)benzoate
L882-0239 Screening compound: ethyl 2-({2-[5-(4-fluorobenzyl)-4-oxo-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidin-2-yl]acetyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L882-0239
ethyl 2-({2-[5-(4-fluorobenzyl)-4-oxo-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidin-2-yl]acetyl}amino)benzoate

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

L882-0239

Molecular Formula

C23H20FN5O4 (C23 H20 FN5 O4)

Compound Name

ethyl 2-({2-[5-(4-fluorobenzyl)-4-oxo-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidin-2-yl]acetyl}amino)benzoate

IUPAC name

ethyl 2-(2-{5-[(4-fluorophenyl)methyl]-4-oxo-2H4H5H-pyrazolo[34-d]pyrimidin-2-yl}acetamido)benzoate

SMILES

CCOC(c(cccc1)c1NC(Cn(cc12)nc2N=CN(Cc(cc2)ccc2F)C1=O)=O)=O

InChI

InChI=1S/C23H20FN5O4/c1-2-33-23(32)17-5-3-4-6-19(17)26-20(30)13-29-12-18-21(27-29)25-14-28(22(18)31)11-15-7-9-16(24)10-8-15/h3-10,12,14H,2,11,13H2,1H3,(H,26,30)

InChI Key

XWXHJYGLMUYPOQ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.600

Distribution Coefficient, logD

2.585

Water Solubility, LogSw

-3.03

Polar Surface Area

84.402

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.39

L882-0239 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 L882-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L882-0239?
Check Price and Availability of L882-0239, 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 L882-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L882-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L882-0239
  • 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 L882-0239 available by request