E626-1167 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-1-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-carboxamide

E626-1167 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-1-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-carboxamide
E626-1167 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-1-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E626-1167
N-[2-(4-ethoxyphenyl)ethyl]-1-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-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

E626-1167

Molecular Formula

C26H28FN5O2S (C26 H28 FN5 O2 S)

Compound Name

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

IUPAC name

N-[2-(4-ethoxyphenyl)ethyl]-1-[6-(4-fluorophenyl)imidazo[21-b][134]thiadiazol-2-yl]piperidine-3-carboxamide

SMILES

CCOc1ccc(CCNC(C(CCC2)CN2c(s2)nn3c2nc(-c(cc2)ccc2F)c3)=O)cc1

InChI

InChI=1S/C26H28FN5O2S/c1-2-34-22-11-5-18(6-12-22)13-14-28-24(33)20-4-3-15-31(16-20)26-30-32-17-23(29-25(32)35-26)19-7-9-21(27)10-8-19/h5-12,17,20H,2-4,13-16H2,1H3,(H,28,33)/t20-/m0/s1

InChI Key

PDCBQHKGXUZXQA-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14905145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.551

Distribution Coefficient, logD

4.551

Water Solubility, LogSw

-4.10

Polar Surface Area

55.838

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

3.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

E626-1167 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 E626-1167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E626-1167?
Check Price and Availability of E626-1167, 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 E626-1167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E626-1167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E626-1167
  • 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 E626-1167 available by request