G070-0732 Screening compound: ethyl 2,5-dimethyl-4-{[2-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-1H-pyrrole-3-carboxylate

G070-0732 Screening compound: ethyl 2,5-dimethyl-4-{[2-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-1H-pyrrole-3-carboxylate
G070-0732 Screening compound: ethyl 2,5-dimethyl-4-{[2-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-0732
ethyl 2,5-dimethyl-4-{[2-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-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

G070-0732

Molecular Formula

C22H27N3O5S (C22 H27 N3 O5 S)

Compound Name

ethyl 2,5-dimethyl-4-{[2-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 25-dimethyl-4-{[2-oxo-2-(4-phenyl-1236-tetrahydropyridin-1-yl)ethyl]sulfamoyl}-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(NCC(N(CC1)CC=C1c1ccccc1)=O)(=O)=O)=O

InChI

InChI=1S/C22H27N3O5S/c1-4-30-22(27)20-15(2)24-16(3)21(20)31(28,29)23-14-19(26)25-12-10-18(11-13-25)17-8-6-5-7-9-17/h5-10,23-24H,4,11-14H2,1-3H3

InChI Key

LGQQJXVZIRQHFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978745

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.647

Distribution Coefficient, logD

2.636

Water Solubility, LogSw

-2.96

Polar Surface Area

89.659

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

G070-0732 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G070-0732 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-0732?
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What is the minimum amount of G070-0732 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-0732
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-0732
  • 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 G070-0732 available by request