P169-1312 Screening compound: N-({2-ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-2,5-dimethylbenzene-1-sulfonamide

P169-1312 Screening compound: N-({2-ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-2,5-dimethylbenzene-1-sulfonamide
P169-1312 Screening compound: N-({2-ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-2,5-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P169-1312
N-({2-ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-2,5-dimethylbenzene-1-sulfonamide

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

P169-1312

Molecular Formula

C21H22N4O2S2 (C21 H22 N4 O2 S2)

Compound Name

N-({2-ethyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl}methyl)-2,5-dimethylbenzene-1-sulfonamide

IUPAC name

N-({2-ethyl-6-phenylimidazo[21-b][134]thiadiazol-5-yl}methyl)-25-dimethylbenzene-1-sulfonamide

SMILES

CCc(s1)nn2c1nc(-c1ccccc1)c2CNS(c1c(C)ccc(C)c1)(=O)=O

InChI

InChI=1S/C21H22N4O2S2/c1-4-19-24-25-17(20(23-21(25)28-19)16-8-6-5-7-9-16)13-22-29(26,27)18-12-14(2)10-11-15(18)3/h5-12,22H,4,13H2,1-3H3

InChI Key

QNIYOVWODFLYQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.685

Distribution Coefficient, logD

4.616

Water Solubility, LogSw

-4.35

Polar Surface Area

63.274

Acid Dissociation Constant (pKa)

8.17

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

P169-1312 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

SmartTM Library (51161 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
Agro:
  • Agro
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P169-1312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P169-1312?
Check Price and Availability of P169-1312, 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 P169-1312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P169-1312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P169-1312
  • 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 P169-1312 available by request