G070-0436 Screening compound: ethyl 2,5-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})sulfamoyl]-1H-pyrrole-3-carboxylate

G070-0436 Screening compound: ethyl 2,5-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})sulfamoyl]-1H-pyrrole-3-carboxylate
G070-0436 Screening compound: ethyl 2,5-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})sulfamoyl]-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-0436
ethyl 2,5-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})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

G070-0436

Molecular Formula

C18H24N4O5S (C18 H24 N4 O5 S)

Compound Name

ethyl 2,5-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})sulfamoyl]-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 25-dimethyl-4-[methyl({[(6-methylpyridin-2-yl)carbamoyl]methyl})sulfamoyl]-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(N(C)CC(Nc1nc(C)ccc1)=O)(=O)=O)=O

InChI

InChI=1S/C18H24N4O5S/c1-6-27-18(24)16-12(3)20-13(4)17(16)28(25,26)22(5)10-15(23)21-14-9-7-8-11(2)19-14/h7-9,20H,6,10H2,1-5H3,(H,19,21,23)

InChI Key

WRSJLPHPWXRUQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.855

Distribution Coefficient, logD

1.854

Water Solubility, LogSw

-2.58

Polar Surface Area

96.483

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

G070-0436 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Dark Chemical Matter Library (18430 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Proteases
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G070-0436 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-0436?
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What is the minimum amount of G070-0436 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-0436
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-0436
  • 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 G070-0436 available by request