E014-0138 Screening compound: 4,6-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

E014-0138 Screening compound: 4,6-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
E014-0138 Screening compound: 4,6-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E014-0138
4,6-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

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

E014-0138

Molecular Formula

C22H21N3OS (C22 H21 N3 OS)

Compound Name

4,6-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

46-dimethyl-N-(2-phenylethyl)-3-(1H-pyrrol-1-yl)thieno[23-b]pyridine-2-carboxamide

SMILES

Cc1c(c(-n2cccc2)c(C(NCCc2ccccc2)=O)s2)c2nc(C)c1

InChI

InChI=1S/C22H21N3OS/c1-15-14-16(2)24-22-18(15)19(25-12-6-7-13-25)20(27-22)21(26)23-11-10-17-8-4-3-5-9-17/h3-9,12-14H,10-11H2,1-2H3,(H,23,26)

InChI Key

OQEDCOVYZVORTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14838016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.571

Distribution Coefficient, logD

4.562

Water Solubility, LogSw

-4.62

Polar Surface Area

37.404

Acid Dissociation Constant (pKa)

15.32

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

E014-0138 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E014-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E014-0138?
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What is the minimum amount of E014-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E014-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E014-0138
  • 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 E014-0138 available by request