E922-1681 Screening compound: ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]benzoate

E922-1681 Screening compound: ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]benzoate
E922-1681 Screening compound: ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E922-1681
ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]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

E922-1681

Molecular Formula

C24H25FN4O3 (C24 H25 FN4 O3)

Compound Name

ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]benzoate

IUPAC name

ethyl 4-[1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-amido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(c1c(C2CCNCC2)n(-c2cccc(F)c2)nc1)=O)=O

InChI

InChI=1S/C24H25FN4O3/c1-2-32-24(31)17-6-8-19(9-7-17)28-23(30)21-15-27-29(20-5-3-4-18(25)14-20)22(21)16-10-12-26-13-11-16/h3-9,14-16,26H,2,10-13H2,1H3,(H,28,30)

InChI Key

BAXPRBRXXYQRIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14928626

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

436.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.248

Distribution Coefficient, logD

-0.233

Water Solubility, LogSw

-3.39

Polar Surface Area

69.059

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

10.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

E922-1681 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with E922-1681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E922-1681?
Check Price and Availability of E922-1681, 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 E922-1681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E922-1681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E922-1681
  • 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 E922-1681 available by request