C066-5372 Screening compound: ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylate

C066-5372 Screening compound: ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylate
C066-5372 Screening compound: ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-5372
ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-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

C066-5372

Molecular Formula

C14H21NO4 (C14 H21 NO4)

Compound Name

ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 2-(2-ethoxy-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylate

SMILES

CCn1c(CC(OCC)=O)c(C(OCC)=O)c(C)c1

InChI

InChI=1S/C14H21NO4/c1-5-15-9-10(4)13(14(17)19-7-3)11(15)8-12(16)18-6-2/h9H,5-8H2,1-4H3

InChI Key

FWFOAZGTOWBIQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14716194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.115

Distribution Coefficient, logD

2.115

Water Solubility, LogSw

-1.76

Polar Surface Area

42.886

Acid Dissociation Constant (pKa)

20.92

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

C066-5372 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Library (67538 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C066-5372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-5372?
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What is the minimum amount of C066-5372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-5372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-5372
  • 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 C066-5372 available by request