E014-0050 Screening compound: 1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine

E014-0050 Screening compound: 1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine
E014-0050 Screening compound: 1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound E014-0050
1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine

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

E014-0050

Molecular Formula

C19H21N3OS (C19 H21 N3 OS)

Compound Name

1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine

IUPAC name

1-[46-dimethyl-3-(1H-pyrrol-1-yl)thieno[23-b]pyridine-2-carbonyl]piperidine

SMILES

Cc1c(c(-n2cccc2)c(C(N2CCCCC2)=O)s2)c2nc(C)c1

InChI

InChI=1S/C19H21N3OS/c1-13-12-14(2)20-18-15(13)16(21-8-6-7-9-21)17(24-18)19(23)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11H2,1-2H3

InChI Key

XLLJUXLIONECDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08254643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.224

Distribution Coefficient, logD

4.177

Water Solubility, LogSw

-4.40

Polar Surface Area

29.798

Acid Dissociation Constant (pKa)

27.95

Base Dissociation Constant (pKb)

6.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

E014-0050 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E014-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E014-0050?
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What is the minimum amount of E014-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E014-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E014-0050
  • 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 E014-0050 available by request