3347-5261 Screening compound: 4-[(3,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylic acid

3347-5261 Screening compound: 4-[(3,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylic acid
3347-5261 Screening compound: 4-[(3,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3347-5261
4-[(3,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylic 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

3347-5261

Molecular Formula

C15H9Cl2NO5 (C15 H9 Cl2 NO5)

Compound Name

4-[(3,5-dichlorophenyl)carbamoyl]benzene-1,3-dicarboxylic acid

IUPAC name

4-[(35-dichlorophenyl)carbamoyl]benzene-13-dicarboxylic acid

SMILES

OC(c(cc1)cc(C(O)=O)c1C(Nc1cc(Cl)cc(Cl)c1)=O)=O

InChI

InChI=1S/C15H9Cl2NO5/c16-8-4-9(17)6-10(5-8)18-13(19)11-2-1-7(14(20)21)3-12(11)15(22)23/h1-6H,(H,18,19)(H,20,21)(H,22,23)

InChI Key

XHMPEAJSWDKLQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02585135

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.15

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.272

Distribution Coefficient, logD

-0.649

Water Solubility, LogSw

-4.34

Polar Surface Area

80.146

Acid Dissociation Constant (pKa)

2.48

Base Dissociation Constant (pKb)

-5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3347-5261 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3347-5261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3347-5261?
Check Price and Availability of 3347-5261, 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 3347-5261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3347-5261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3347-5261
  • 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 3347-5261 available by request