G793-0503 Screening compound: ethyl 4-[3-(4-{[2-(2-methoxyphenyl)ethyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

G793-0503 Screening compound: ethyl 4-[3-(4-{[2-(2-methoxyphenyl)ethyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
G793-0503 Screening compound: ethyl 4-[3-(4-{[2-(2-methoxyphenyl)ethyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0503
ethyl 4-[3-(4-{[2-(2-methoxyphenyl)ethyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-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

G793-0503

Molecular Formula

C27H37N3O5 (C27 H37 N3 O5)

Compound Name

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

IUPAC name

ethyl 4-[3-(4-{[2-(2-methoxyphenyl)ethyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CCC(N(CC2)CCC2C(NCCc(cccc2)c2OC)=O)=O)c(C)[nH]1)=O

InChI

InChI=1S/C27H37N3O5/c1-5-35-27(33)25-18(2)22(19(3)29-25)10-11-24(31)30-16-13-21(14-17-30)26(32)28-15-12-20-8-6-7-9-23(20)34-4/h6-9,21,29H,5,10-17H2,1-4H3,(H,28,32)

InChI Key

JJDZXPJCNMJKRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27159074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.021

Distribution Coefficient, logD

3.021

Water Solubility, LogSw

-3.12

Polar Surface Area

79.980

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.90

G793-0503 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Eccentric PPI Library (11937 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PLpro Library (6343 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G793-0503 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0503?
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What is the minimum amount of G793-0503 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0503
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0503
  • 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 G793-0503 available by request