E626-0490 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-4-carboxamide

E626-0490 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-4-carboxamide
E626-0490 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E626-0490
N-[(2-ethoxyphenyl)methyl]-1-[6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]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

E626-0490

Molecular Formula

C26H29N5O2S (C26 H29 N5 O2 S)

Compound Name

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

IUPAC name

N-[(2-ethoxyphenyl)methyl]-1-[6-(4-methylphenyl)imidazo[21-b][134]thiadiazol-2-yl]piperidine-4-carboxamide

SMILES

CCOc1c(CNC(C(CC2)CCN2c(s2)nn3c2nc(-c2ccc(C)cc2)c3)=O)cccc1

InChI

InChI=1S/C26H29N5O2S/c1-3-33-23-7-5-4-6-21(23)16-27-24(32)20-12-14-30(15-13-20)26-29-31-17-22(28-25(31)34-26)19-10-8-18(2)9-11-19/h4-11,17,20H,3,12-16H2,1-2H3,(H,27,32)

InChI Key

MCTNKAYAJYSZSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14904894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

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

5.029

Distribution Coefficient, logD

5.029

Water Solubility, LogSw

-4.45

Polar Surface Area

56.150

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

E626-0490 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E626-0490 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E626-0490?
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What is the minimum amount of E626-0490 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E626-0490
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E626-0490
  • 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 E626-0490 available by request