G889-0337 Screening compound: 5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-1-yl]benzoic acid

G889-0337 Screening compound: 5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-1-yl]benzoic acid
G889-0337 Screening compound: 5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-1-yl]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G889-0337
5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-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

G889-0337

Molecular Formula

C25H24ClN3O4 (C25 H24 ClN3 O4)

Compound Name

5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-1-yl]benzoic acid

IUPAC name

5-(2-chlorobenzamido)-2-[4-(3-methoxyphenyl)piperazin-1-yl]benzoic acid

SMILES

COc1cccc(N(CC2)CCN2c(ccc(NC(c(cccc2)c2Cl)=O)c2)c2C(O)=O)c1

InChI

InChI=1S/C25H24ClN3O4/c1-33-19-6-4-5-18(16-19)28-11-13-29(14-12-28)23-10-9-17(15-21(23)25(31)32)27-24(30)20-7-2-3-8-22(20)26/h2-10,15-16H,11-14H2,1H3,(H,27,30)(H,31,32)

InChI Key

CCWIJRUEBKQYCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15073098

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

465.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.052

Distribution Coefficient, logD

2.802

Water Solubility, LogSw

-4.73

Polar Surface Area

65.693

Acid Dissociation Constant (pKa)

5.15

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G889-0337 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 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 G889-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G889-0337?
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What is the minimum amount of G889-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G889-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G889-0337
  • 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 G889-0337 available by request