E734-2516 Screening compound: 6-[2-(4-{[1,4'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

E734-2516 Screening compound: 6-[2-(4-{[1,4'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione
E734-2516 Screening compound: 6-[2-(4-{[1,4'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound E734-2516
6-[2-(4-{[1,4'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-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

E734-2516

Molecular Formula

C25H30N4O4S (C25 H30 N4 O4 S)

Compound Name

6-[2-(4-{[1,4'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

IUPAC name

6-[2-(4-{[14'-bipiperidine]-1'-sulfonyl}phenyl)ethyl]-5H6H7H-pyrrolo[34-b]pyridine-57-dione

SMILES

O=C(c1c2nccc1)N(CCc(cc1)ccc1S(N(CC1)CCC1N1CCCCC1)(=O)=O)C2=O

InChI

InChI=1S/C25H30N4O4S/c30-24-22-5-4-13-26-23(22)25(31)29(24)18-10-19-6-8-21(9-7-19)34(32,33)28-16-11-20(12-17-28)27-14-2-1-3-15-27/h4-9,13,20H,1-3,10-12,14-18H2

InChI Key

LBRFERFWBILUAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913736

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.6

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

1.873

Distribution Coefficient, logD

-0.386

Water Solubility, LogSw

-2.51

Polar Surface Area

74.183

Acid Dissociation Constant (pKa)

26.20

Base Dissociation Constant (pKb)

9.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

E734-2516 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with E734-2516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E734-2516?
Check Price and Availability of E734-2516, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E734-2516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E734-2516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E734-2516
  • 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 E734-2516 available by request