E014-0245 Screening compound: 4,6-dimethyl-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide

E014-0245 Screening compound: 4,6-dimethyl-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
E014-0245 Screening compound: 4,6-dimethyl-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E014-0245
4,6-dimethyl-N-[3-(4-propylpiperazin-1-yl)propyl]-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

E014-0245

Molecular Formula

C24H33N5OS (C24 H33 N5 OS)

Compound Name

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

IUPAC name

46-dimethyl-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(1H-pyrrol-1-yl)thieno[23-b]pyridine-2-carboxamide

SMILES

CCCN1CCN(CCCNC(c(sc2nc(C)cc(C)c22)c2-n2cccc2)=O)CC1

InChI

InChI=1S/C24H33N5OS/c1-4-9-27-13-15-28(16-14-27)10-7-8-25-23(30)22-21(29-11-5-6-12-29)20-18(2)17-19(3)26-24(20)31-22/h5-6,11-12,17H,4,7-10,13-16H2,1-3H3,(H,25,30)

InChI Key

LZSGNVOMBLITJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27597348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.559

Distribution Coefficient, logD

2.594

Water Solubility, LogSw

-3.95

Polar Surface Area

45.177

Acid Dissociation Constant (pKa)

16.45

Base Dissociation Constant (pKb)

8.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

E014-0245 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 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 E014-0245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E014-0245?
Check Price and Availability of E014-0245, 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 E014-0245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E014-0245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E014-0245
  • 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 E014-0245 available by request