C721-0026 Screening compound: ethyl 2,4-dimethyl-1-{2-[(6-methyl-2-pyridyl)amino]-2-oxoethyl}-5-phenyl-1H-pyrrole-3-carboxylate

C721-0026 Screening compound: ethyl 2,4-dimethyl-1-{2-[(6-methyl-2-pyridyl)amino]-2-oxoethyl}-5-phenyl-1H-pyrrole-3-carboxylate
C721-0026 Screening compound: ethyl 2,4-dimethyl-1-{2-[(6-methyl-2-pyridyl)amino]-2-oxoethyl}-5-phenyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C721-0026
ethyl 2,4-dimethyl-1-{2-[(6-methyl-2-pyridyl)amino]-2-oxoethyl}-5-phenyl-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

C721-0026

Molecular Formula

C23H25N3O3 (C23 H25 N3 O3)

Compound Name

ethyl 2,4-dimethyl-1-{2-[(6-methyl-2-pyridyl)amino]-2-oxoethyl}-5-phenyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 24-dimethyl-1-{[(6-methylpyridin-2-yl)carbamoyl]methyl}-5-phenyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)n(CC(Nc2nc(C)ccc2)=O)c(-c2ccccc2)c1C)=O

InChI

InChI=1S/C23H25N3O3/c1-5-29-23(28)21-16(3)22(18-11-7-6-8-12-18)26(17(21)4)14-20(27)25-19-13-9-10-15(2)24-19/h6-13H,5,14H2,1-4H3,(H,24,25,27)

InChI Key

CPWXAVHYIDFDCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14787883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.285

Distribution Coefficient, logD

4.285

Water Solubility, LogSw

-4.32

Polar Surface Area

53.586

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.09

C721-0026 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C721-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C721-0026?
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What is the minimum amount of C721-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C721-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C721-0026
  • 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 C721-0026 available by request