E734-2558 Screening compound: 4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)-N-(2-methoxy-5-methylphenyl)benzene-1-sulfonamide

E734-2558 Screening compound: 4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)-N-(2-methoxy-5-methylphenyl)benzene-1-sulfonamide
E734-2558 Screening compound: 4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)-N-(2-methoxy-5-methylphenyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E734-2558
4-(2-{5,7-dioxo-5H,6H,7H-pyrrolo[3,4-b]pyridin-6-yl}ethyl)-N-(2-methoxy-5-methylphenyl)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

E734-2558

Molecular Formula

C23H21N3O5S (C23 H21 N3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)cc(NS(c2ccc(CCN(C(c3c4nccc3)=O)C4=O)cc2)(=O)=O)c1OC

InChI

InChI=1S/C23H21N3O5S/c1-15-5-10-20(31-2)19(14-15)25-32(29,30)17-8-6-16(7-9-17)11-13-26-22(27)18-4-3-12-24-21(18)23(26)28/h3-10,12,14,25H,11,13H2,1-2H3

InChI Key

GOVHIPCQEVFZTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913757

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.035

Distribution Coefficient, logD

1.800

Water Solubility, LogSw

-2.92

Polar Surface Area

86.961

Acid Dissociation Constant (pKa)

7.54

Base Dissociation Constant (pKb)

-5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

E734-2558 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 E734-2558 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E734-2558?
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What is the minimum amount of E734-2558 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E734-2558
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E734-2558
  • 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 E734-2558 available by request