G726-1177 Screening compound: ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

G726-1177 Screening compound: ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
G726-1177 Screening compound: ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G726-1177
ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-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

G726-1177

Molecular Formula

C22H27N3O3 (C22 H27 N3 O3)

Compound Name

ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 5-(2-{[2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(CCC(NCCc2c[nH]c3c2cccc3)=O)c1C)=O

InChI

InChI=1S/C22H27N3O3/c1-4-28-22(27)21-14(2)18(25-15(21)3)9-10-20(26)23-12-11-16-13-24-19-8-6-5-7-17(16)19/h5-8,13,24-25H,4,9-12H2,1-3H3,(H,23,26)

InChI Key

RWHDBIONVRBUCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27154365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.759

Distribution Coefficient, logD

2.759

Water Solubility, LogSw

-2.84

Polar Surface Area

66.381

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

-0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

G726-1177 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G726-1177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G726-1177?
Check Price and Availability of G726-1177, 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 G726-1177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G726-1177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G726-1177
  • 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 G726-1177 available by request