2922-0102 Screening compound: 3,5-bis(3-carboxypropanamido)benzoic acid

2922-0102 Screening compound: 3,5-bis(3-carboxypropanamido)benzoic acid
2922-0102 Screening compound: 3,5-bis(3-carboxypropanamido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2922-0102
3,5-bis(3-carboxypropanamido)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

2922-0102

Molecular Formula

C15H16N2O8 (C15 H16 N2 O8)

Compound Name

3,5-bis(3-carboxypropanamido)benzoic acid

IUPAC name

35-bis(3-carboxypropanamido)benzoic acid

SMILES

OC(CCC(Nc1cc(C(O)=O)cc(NC(CCC(O)=O)=O)c1)=O)=O

InChI

InChI=1S/C15H16N2O8/c18-11(1-3-13(20)21)16-9-5-8(15(24)25)6-10(7-9)17-12(19)2-4-14(22)23/h5-7H,1-4H2,(H,16,18)(H,17,19)(H,20,21)(H,22,23)(H,24,25)

InChI Key

WZAXTYUTZBIWNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00375927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.3

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.208

Distribution Coefficient, logD

-3.157

Water Solubility, LogSw

-1.48

Polar Surface Area

131.713

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

2922-0102 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2922-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2922-0102?
Check Price and Availability of 2922-0102, 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 2922-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2922-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2922-0102
  • 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 2922-0102 available by request