G889-1771 Screening compound: 5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid

G889-1771 Screening compound: 5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid
G889-1771 Screening compound: 5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G889-1771
5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid

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

G889-1771

Molecular Formula

C20H22ClN3O3 (C20 H22 ClN3 O3)

Compound Name

5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid

IUPAC name

5-(4-chlorobenzamido)-2-(4-ethylpiperazin-1-yl)benzoic acid

SMILES

CCN(CC1)CCN1c(ccc(NC(c(cc1)ccc1Cl)=O)c1)c1C(O)=O

InChI

InChI=1S/C20H22ClN3O3/c1-2-23-9-11-24(12-10-23)18-8-7-16(13-17(18)20(26)27)22-19(25)14-3-5-15(21)6-4-14/h3-8,13H,2,9-12H2,1H3,(H,22,25)(H,26,27)

InChI Key

WUFLOCFKVDCUJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15073292

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

387.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.611

Distribution Coefficient, logD

3.611

Water Solubility, LogSw

-4.01

Polar Surface Area

58.426

Acid Dissociation Constant (pKa)

5.15

Base Dissociation Constant (pKb)

8.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

G889-1771 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G889-1771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G889-1771?
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What is the minimum amount of G889-1771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G889-1771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G889-1771
  • 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 G889-1771 available by request