G726-1657 Screening compound: ethyl 1,2,4-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-1H-pyrrole-3-carboxylate

G726-1657 Screening compound: ethyl 1,2,4-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-1H-pyrrole-3-carboxylate
G726-1657 Screening compound: ethyl 1,2,4-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G726-1657
ethyl 1,2,4-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-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

G726-1657

Molecular Formula

C22H30N4O3 (C22 H30 N4 O3)

Compound Name

ethyl 1,2,4-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 124-trimethyl-5-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)n(C)c(CCC(N(CC2)CCN2c2ncccc2)=O)c1C)=O

InChI

InChI=1S/C22H30N4O3/c1-5-29-22(28)21-16(2)18(24(4)17(21)3)9-10-20(27)26-14-12-25(13-15-26)19-8-6-7-11-23-19/h6-8,11H,5,9-10,12-15H2,1-4H3

InChI Key

CBNFHCSYQFVJBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27154484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.478

Distribution Coefficient, logD

2.469

Water Solubility, LogSw

-2.19

Polar Surface Area

51.174

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G726-1657 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G726-1657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G726-1657?
Check Price and Availability of G726-1657, 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 G726-1657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G726-1657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G726-1657
  • 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 G726-1657 available by request