E786-1927 Screening compound: 6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

E786-1927 Screening compound: 6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione
E786-1927 Screening compound: 6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound E786-1927
6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)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

E786-1927

Molecular Formula

C23H22N4O5S2 (C23 H22 N4 O5 S2)

Compound Name

6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methyl]-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione

IUPAC name

6-[(5-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methyl]-5H6H7H-pyrrolo[34-b]pyridine-57-dione

SMILES

COc(cccc1)c1N(CC1)CCN1S(c1ccc(CN(C(c2c3nccc2)=O)C3=O)s1)(=O)=O

InChI

InChI=1S/C23H22N4O5S2/c1-32-19-7-3-2-6-18(19)25-11-13-26(14-12-25)34(30,31)20-9-8-16(33-20)15-27-22(28)17-5-4-10-24-21(17)23(27)29/h2-10H,11-15H2,1H3

InChI Key

UBFQQAFXCYRGFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14918991

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.956

Distribution Coefficient, logD

1.956

Water Solubility, LogSw

-2.69

Polar Surface Area

82.719

Acid Dissociation Constant (pKa)

28.26

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

E786-1927 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

Purinergic Library (3321 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 E786-1927 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E786-1927?
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What is the minimum amount of E786-1927 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E786-1927
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E786-1927
  • 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 E786-1927 available by request