C175-0054 Screening compound: ethyl 3-(2,3-dimethoxybenzamido)-1H-indole-2-carboxylate

C175-0054 Screening compound: ethyl 3-(2,3-dimethoxybenzamido)-1H-indole-2-carboxylate
C175-0054 Screening compound: ethyl 3-(2,3-dimethoxybenzamido)-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C175-0054
ethyl 3-(2,3-dimethoxybenzamido)-1H-indole-2-carboxylate

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

C175-0054

Molecular Formula

C20H20N2O5 (C20 H20 N2 O5)

Compound Name

ethyl 3-(2,3-dimethoxybenzamido)-1H-indole-2-carboxylate

IUPAC name

ethyl 3-(23-dimethoxybenzamido)-1H-indole-2-carboxylate

SMILES

CCOC(c([nH]c1c2cccc1)c2NC(c(cccc1OC)c1OC)=O)=O

InChI

InChI=1S/C20H20N2O5/c1-4-27-20(24)17-16(12-8-5-6-10-14(12)21-17)22-19(23)13-9-7-11-15(25-2)18(13)26-3/h5-11,21H,4H2,1-3H3,(H,22,23)

InChI Key

SUCAZGSDIQIEFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04459859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.498

Distribution Coefficient, logD

1.359

Water Solubility, LogSw

-2.93

Polar Surface Area

68.155

Acid Dissociation Constant (pKa)

6.29

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C175-0054 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Serine Proteases Inhibitors Library (32732 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C175-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C175-0054?
Check Price and Availability of C175-0054, 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 C175-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C175-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C175-0054
  • 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 C175-0054 available by request