0411-0057 Screening compound: 2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[2,1-b][1,3,4]thiadiazole

0411-0057 Screening compound: 2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[2,1-b][1,3,4]thiadiazole
0411-0057 Screening compound: 2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[2,1-b][1,3,4]thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0411-0057
2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[2,1-b][1,3,4]thiadiazole

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

0411-0057

Molecular Formula

C25H28ClN3OS (C25 H28 ClN3 OS)

Compound Name

2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[2,1-b][1,3,4]thiadiazole

IUPAC name

2-(2-chlorophenyl)-6-[4-(nonyloxy)phenyl]imidazo[21-b][134]thiadiazole

SMILES

CCCCCCCCCOc(cc1)ccc1-c1cn2nc(-c(cccc3)c3Cl)sc2n1

InChI

InChI=1S/C25H28ClN3OS/c1-2-3-4-5-6-7-10-17-30-20-15-13-19(14-16-20)23-18-29-25(27-23)31-24(28-29)21-11-8-9-12-22(21)26/h8-9,11-16,18H,2-7,10,17H2,1H3

InChI Key

MIFROHHCIZKCKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00839813

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.04

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.922

Distribution Coefficient, logD

8.922

Water Solubility, LogSw

-6.57

Polar Surface Area

28.405

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

2.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with 0411-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0411-0057?
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What is the minimum amount of 0411-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0411-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0411-0057
  • 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 0411-0057 available by request