3002-0530 Screening compound: ethyl 3-(pyridine-4-amido)benzoate

3002-0530 Screening compound: ethyl 3-(pyridine-4-amido)benzoate
3002-0530 Screening compound: ethyl 3-(pyridine-4-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3002-0530
ethyl 3-(pyridine-4-amido)benzoate

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

3002-0530

Molecular Formula

C15H14N2O3 (C15 H14 N2 O3)

Compound Name

ethyl 3-(pyridine-4-amido)benzoate

IUPAC name

ethyl 3-(pyridine-4-amido)benzoate

SMILES

CCOC(c1cc(NC(c2ccncc2)=O)ccc1)=O

InChI

InChI=1S/C15H14N2O3/c1-2-20-15(19)12-4-3-5-13(10-12)17-14(18)11-6-8-16-9-7-11/h3-10H,2H2,1H3,(H,17,18)

InChI Key

USUGIQYFHNNYRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02165803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.554

Distribution Coefficient, logD

2.552

Water Solubility, LogSw

-2.59

Polar Surface Area

53.512

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

3002-0530 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Proteases
  • Phosphatases

References: we are preparing a list of scientific research reports with 3002-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3002-0530?
Check Price and Availability of 3002-0530, 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 3002-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3002-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3002-0530
  • 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 3002-0530 available by request