E734-2712 Screening compound: 6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

E734-2712 Screening compound: 6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione
E734-2712 Screening compound: 6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound E734-2712
6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

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

E734-2712

Molecular Formula

C25H24N4O4S (C25 H24 N4 O4 S)

Compound Name

6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

IUPAC name

6-({4-[(4-benzylpiperazin-1-yl)sulfonyl]phenyl}methyl)-5H6H7H-pyrrolo[34-b]pyridine-57-dione

SMILES

O=C(c1c2nccc1)N(Cc(cc1)ccc1S(N1CCN(Cc3ccccc3)CC1)(=O)=O)C2=O

InChI

InChI=1S/C25H24N4O4S/c30-24-22-7-4-12-26-23(22)25(31)29(24)18-20-8-10-21(11-9-20)34(32,33)28-15-13-27(14-16-28)17-19-5-2-1-3-6-19/h1-12H,13-18H2

InChI Key

AJBFUWKSNIHSIZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.742

Distribution Coefficient, logD

1.735

Water Solubility, LogSw

-2.79

Polar Surface Area

74.652

Acid Dissociation Constant (pKa)

28.13

Base Dissociation Constant (pKb)

5.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

E734-2712 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Purinergic Library (3321 compounds)

Targeted Diversity Library (40567 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Digestive system
  • Nervous system
Targets:
  • Proteases
  • GPCR
  • Ion Channels
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E734-2712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E734-2712?
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What is the minimum amount of E734-2712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E734-2712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E734-2712
  • 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 E734-2712 available by request