E626-0659 Screening compound: 1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide

E626-0659 Screening compound: 1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide
E626-0659 Screening compound: 1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E626-0659
1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-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

E626-0659

Molecular Formula

C23H25N5O2S2 (C23 H25 N5 O2 S2)

Compound Name

1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide

IUPAC name

1-[6-(4-methoxyphenyl)imidazo[21-b][134]thiadiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide

SMILES

COc(cc1)ccc1-c1cn2nc(N(CC3)CCC3C(NCCc3cccs3)=O)sc2n1

InChI

InChI=1S/C23H25N5O2S2/c1-30-18-6-4-16(5-7-18)20-15-28-22(25-20)32-23(26-28)27-12-9-17(10-13-27)21(29)24-11-8-19-3-2-14-31-19/h2-7,14-15,17H,8-13H2,1H3,(H,24,29)

InChI Key

QQJBWLQXVAUKJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14904982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.111

Distribution Coefficient, logD

4.111

Water Solubility, LogSw

-3.92

Polar Surface Area

57.343

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

E626-0659 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E626-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E626-0659?
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What is the minimum amount of E626-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E626-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E626-0659
  • 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 E626-0659 available by request