1493-0485 Screening compound: methyl 2-(pyridine-3-amido)benzoate

1493-0485 Screening compound: methyl 2-(pyridine-3-amido)benzoate
1493-0485 Screening compound: methyl 2-(pyridine-3-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1493-0485
methyl 2-(pyridine-3-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

1493-0485

Molecular Formula

C14H12N2O3 (C14 H12 N2 O3)

Compound Name

methyl 2-(pyridine-3-amido)benzoate

IUPAC name

methyl 2-(pyridine-3-amido)benzoate

SMILES

COC(c(cccc1)c1NC(c1cnccc1)=O)=O

InChI

InChI=1S/C14H12N2O3/c1-19-14(18)11-6-2-3-7-12(11)16-13(17)10-5-4-8-15-9-10/h2-9H,1H3,(H,16,17)

InChI Key

YZWPSBHRDLVINI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00690330

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

256.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.756

Distribution Coefficient, logD

1.184

Water Solubility, LogSw

-1.84

Polar Surface Area

53.323

Acid Dissociation Constant (pKa)

6.96

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

1493-0485 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 1493-0485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1493-0485?
Check Price and Availability of 1493-0485, 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 1493-0485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1493-0485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1493-0485
  • 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 1493-0485 available by request