P169-0020 Screening compound: 2-chloro-N-({2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide

P169-0020 Screening compound: 2-chloro-N-({2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide
P169-0020 Screening compound: 2-chloro-N-({2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P169-0020
2-chloro-N-({2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide

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

P169-0020

Molecular Formula

C15H15ClN4OS2 (C15 H15 ClN4 OS2)

Compound Name

2-chloro-N-({2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide

IUPAC name

2-chloro-N-({26-dimethylimidazo[21-b][134]thiadiazol-5-yl}methyl)-5-(methylsulfanyl)benzamide

SMILES

Cc1c(CNC(c(cc(cc2)SC)c2Cl)=O)n2nc(C)sc2n1

InChI

InChI=1S/C15H15ClN4OS2/c1-8-13(20-15(18-8)23-9(2)19-20)7-17-14(21)11-6-10(22-3)4-5-12(11)16/h4-6H,7H2,1-3H3,(H,17,21)

InChI Key

DTHIJSSVXINAEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27643867

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.266

Distribution Coefficient, logD

3.266

Water Solubility, LogSw

-3.74

Polar Surface Area

45.319

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

P169-0020 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with P169-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P169-0020?
Check Price and Availability of P169-0020, 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 P169-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P169-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P169-0020
  • 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 P169-0020 available by request