G793-0080 Screening compound: ethyl 4-{2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

G793-0080 Screening compound: ethyl 4-{2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
G793-0080 Screening compound: ethyl 4-{2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0080
ethyl 4-{2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]ethyl}-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

G793-0080

Molecular Formula

C20H25ClN2O5 (C20 H25 ClN2 O5)

Compound Name

ethyl 4-{2-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{2-[(5-chloro-24-dimethoxyphenyl)carbamoyl]ethyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CCC(Nc(c(OC)c2)cc(Cl)c2OC)=O)c(C)[nH]1)=O

InChI

InChI=1S/C20H25ClN2O5/c1-6-28-20(25)19-11(2)13(12(3)22-19)7-8-18(24)23-15-9-14(21)16(26-4)10-17(15)27-5/h9-10,22H,6-8H2,1-5H3,(H,23,24)

InChI Key

UUALKSLBQBCNRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27158903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.563

Distribution Coefficient, logD

3.537

Water Solubility, LogSw

-3.59

Polar Surface Area

69.414

Acid Dissociation Constant (pKa)

8.60

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G793-0080 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G793-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0080?
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What is the minimum amount of G793-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0080
  • 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 G793-0080 available by request