G726-1278 Screening compound: ethyl 5-(2-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

G726-1278 Screening compound: ethyl 5-(2-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
G726-1278 Screening compound: ethyl 5-(2-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}ethyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G726-1278
ethyl 5-(2-{[3-(4-benzylpiperidin-1-yl)propyl]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

G726-1278

Molecular Formula

C27H39N3O3 (C27 H39 N3 O3)

Compound Name

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

IUPAC name

ethyl 5-(2-{[3-(4-benzylpiperidin-1-yl)propyl]carbamoyl}ethyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(CCC(NCCCN2CCC(Cc3ccccc3)CC2)=O)c1C)=O

InChI

InChI=1S/C27H39N3O3/c1-4-33-27(32)26-20(2)24(29-21(26)3)11-12-25(31)28-15-8-16-30-17-13-23(14-18-30)19-22-9-6-5-7-10-22/h5-7,9-10,23,29H,4,8,11-19H2,1-3H3,(H,28,31)

InChI Key

SIYPYXICVTXUPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27154418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.808

Distribution Coefficient, logD

1.716

Water Solubility, LogSw

-4.07

Polar Surface Area

60.221

Acid Dissociation Constant (pKa)

15.25

Base Dissociation Constant (pKb)

9.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

G726-1278 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with G726-1278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G726-1278?
Check Price and Availability of G726-1278, 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 G726-1278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G726-1278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G726-1278
  • 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 G726-1278 available by request