T404-1798 Screening compound: N-(1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-carboxamide

T404-1798 Screening compound: N-(1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-carboxamide
T404-1798 Screening compound: N-(1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T404-1798
N-(1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-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

T404-1798

Molecular Formula

C16H16ClN5OS (C16 H16 ClN5 OS)

Compound Name

N-(1-{6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-carboxamide

IUPAC name

N-(1-{6-chloro-[124]triazolo[43-a]pyridin-3-yl}piperidin-4-yl)thiophene-3-carboxamide

SMILES

O=C(c1cscc1)NC(CC1)CCN1c1nnc(cc2)n1cc2Cl

InChI

InChI=1S/C16H16ClN5OS/c17-12-1-2-14-19-20-16(22(14)9-12)21-6-3-13(4-7-21)18-15(23)11-5-8-24-10-11/h1-2,5,8-10,13H,3-4,6-7H2,(H,18,23)

InChI Key

CKHDSMGROQCUCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28121340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.606

Distribution Coefficient, logD

2.606

Water Solubility, LogSw

-3.45

Polar Surface Area

49.700

Acid Dissociation Constant (pKa)

15.81

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

T404-1798 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T404-1798 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T404-1798?
Check Price and Availability of T404-1798, 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 T404-1798 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T404-1798
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T404-1798
  • 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 T404-1798 available by request