C202-3561 Screening compound: 4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one

C202-3561 Screening compound: 4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one
C202-3561 Screening compound: 4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-3561
4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one

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

C202-3561

Molecular Formula

C23H16ClF2NO2 (C23 H16 ClF2 NO2)

Compound Name

4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one

IUPAC name

4-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-hydroxy-25-dihydro-1H-pyrrol-2-one

SMILES

OC(C(N(Cc(cc1)ccc1F)C1c(cc2)ccc2F)=O)=C1c(cc1)ccc1Cl

InChI

InChI=1S/C23H16ClF2NO2/c24-17-7-3-15(4-8-17)20-21(16-5-11-19(26)12-6-16)27(23(29)22(20)28)13-14-1-9-18(25)10-2-14/h1-12,21,28H,13H2/t21-/m1/s1

InChI Key

CHDVBVDKJCBFKC-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD26963369

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.84

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.974

Distribution Coefficient, logD

4.973

Water Solubility, LogSw

-5.21

Polar Surface Area

31.088

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

-6.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

8.70

C202-3561 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Targeted Diversity Library (40567 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C202-3561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-3561?
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What is the minimum amount of C202-3561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-3561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-3561
  • 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 C202-3561 available by request