E734-2556 Screening compound: N-(2-chloro-4-fluorophenyl)-4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide

E734-2556 Screening compound: N-(2-chloro-4-fluorophenyl)-4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide
E734-2556 Screening compound: N-(2-chloro-4-fluorophenyl)-4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E734-2556
N-(2-chloro-4-fluorophenyl)-4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide

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

E734-2556

Molecular Formula

C21H15ClFN3O4S (C21 H15 ClFN3 O4 S)

Compound Name

N-(2-chloro-4-fluorophenyl)-4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide

IUPAC name

N-(2-chloro-4-fluorophenyl)-4-(2-{57-dioxo-5H6H7H-pyrrolo[34-b]pyridin-6-yl}ethyl)benzene-1-sulfonamide

SMILES

O=C(c1c2nccc1)N(CCc(cc1)ccc1S(Nc(ccc(F)c1)c1Cl)(=O)=O)C2=O

InChI

InChI=1S/C21H15ClFN3O4S/c22-17-12-14(23)5-8-18(17)25-31(29,30)15-6-3-13(4-7-15)9-11-26-20(27)16-2-1-10-24-19(16)21(26)28/h1-8,10,12,25H,9,11H2

InChI Key

QLMJNWOHCASAAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.89

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.663

Distribution Coefficient, logD

0.388

Water Solubility, LogSw

-3.63

Polar Surface Area

79.330

Acid Dissociation Constant (pKa)

5.13

Base Dissociation Constant (pKb)

-5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

E734-2556 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 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 E734-2556 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E734-2556?
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What is the minimum amount of E734-2556 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E734-2556
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E734-2556
  • 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 E734-2556 available by request