G889-2075 Screening compound: 2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)benzoic acid

G889-2075 Screening compound: 2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)benzoic acid
G889-2075 Screening compound: 2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G889-2075
2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)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

G889-2075

Molecular Formula

C20H20ClN3O4 (C20 H20 ClN3 O4)

Compound Name

2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)benzoic acid

IUPAC name

2-(4-acetylpiperazin-1-yl)-5-(3-chlorobenzamido)benzoic acid

SMILES

CC(N(CC1)CCN1c(ccc(NC(c1cccc(Cl)c1)=O)c1)c1C(O)=O)=O

InChI

InChI=1S/C20H20ClN3O4/c1-13(25)23-7-9-24(10-8-23)18-6-5-16(12-17(18)20(27)28)22-19(26)14-3-2-4-15(21)11-14/h2-6,11-12H,7-10H2,1H3,(H,22,26)(H,27,28)

InChI Key

RYOBQFQPMUPGLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15073322

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

401.85

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.159

Distribution Coefficient, logD

0.908

Water Solubility, LogSw

-3.60

Polar Surface Area

72.085

Acid Dissociation Constant (pKa)

5.15

Base Dissociation Constant (pKb)

5.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G889-2075 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G889-2075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G889-2075?
Check Price and Availability of G889-2075, 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 G889-2075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G889-2075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G889-2075
  • 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 G889-2075 available by request