0459-0006 Screening compound: 2,6-bis(4-heptylphenyl)imidazo[2,1-b][1,3,4]thiadiazole

0459-0006 Screening compound: 2,6-bis(4-heptylphenyl)imidazo[2,1-b][1,3,4]thiadiazole
0459-0006 Screening compound: 2,6-bis(4-heptylphenyl)imidazo[2,1-b][1,3,4]thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0459-0006
2,6-bis(4-heptylphenyl)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

0459-0006

Molecular Formula

C30H39N3S (C30 H39 N3 S)

Compound Name

2,6-bis(4-heptylphenyl)imidazo[2,1-b][1,3,4]thiadiazole

IUPAC name

26-bis(4-heptylphenyl)imidazo[21-b][134]thiadiazole

SMILES

CCCCCCCc(cc1)ccc1-c1cn2nc(-c3ccc(CCCCCCC)cc3)sc2n1

InChI

InChI=1S/C30H39N3S/c1-3-5-7-9-11-13-24-15-19-26(20-16-24)28-23-33-30(31-28)34-29(32-33)27-21-17-25(18-22-27)14-12-10-8-6-4-2/h15-23H,3-14H2,1-2H3

InChI Key

KEZKSDCTRHIRGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00986514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.73

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

11.567

Distribution Coefficient, logD

11.567

Water Solubility, LogSw

-6.01

Polar Surface Area

20.987

Acid Dissociation Constant (pKa)

26.39

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

References: we are preparing a list of scientific research reports with 0459-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0459-0006?
Check Price and Availability of 0459-0006, 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 0459-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0459-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0459-0006
  • 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 0459-0006 available by request