2712-4777 Screening compound: methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate

2712-4777 Screening compound: methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate
2712-4777 Screening compound: methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2712-4777
methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate

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

2712-4777

Molecular Formula

C14H12ClNO5 (C14 H12 ClNO5)

Compound Name

methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate

IUPAC name

methyl 5-chloro-4-(furan-2-amido)-2-methoxybenzoate

SMILES

COC(c(c(OC)c1)cc(Cl)c1NC(c1ccco1)=O)=O

InChI

InChI=1S/C14H12ClNO5/c1-19-12-7-10(9(15)6-8(12)14(18)20-2)16-13(17)11-4-3-5-21-11/h3-7H,1-2H3,(H,16,17)

InChI Key

GUQQDBIXVPXGFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01847972

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.71

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.282

Distribution Coefficient, logD

2.810

Water Solubility, LogSw

-3.72

Polar Surface Area

60.014

Acid Dissociation Constant (pKa)

7.11

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

2712-4777 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • Receptor's ligands
Agro:
  • Agro
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 2712-4777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2712-4777?
Check Price and Availability of 2712-4777, 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 2712-4777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2712-4777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2712-4777
  • 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 2712-4777 available by request