T482-0646 Screening compound: N-{2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-carboxamide

T482-0646 Screening compound: N-{2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-carboxamide
T482-0646 Screening compound: N-{2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T482-0646
N-{2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-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

T482-0646

Molecular Formula

C16H13F3N4OS (C16 H13 F3 N4 OS)

Compound Name

N-{2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-carboxamide

IUPAC name

N-{2-cyclobutyl-[124]triazolo[15-a]pyridin-8-yl}-5-(trifluoromethyl)thiophene-2-carboxamide

SMILES

O=C(c1ccc(C(F)(F)F)s1)Nc1cccn2nc(C3CCC3)nc12

InChI

InChI=1S/C16H13F3N4OS/c17-16(18,19)12-7-6-11(25-12)15(24)20-10-5-2-8-23-14(10)21-13(22-23)9-3-1-4-9/h2,5-9H,1,3-4H2,(H,20,24)

InChI Key

UZKQJJFUEJDXDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29024379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.531

Distribution Coefficient, logD

3.530

Water Solubility, LogSw

-3.68

Polar Surface Area

45.590

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

T482-0646 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

C-Met Library (15277 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with T482-0646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T482-0646?
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What is the minimum amount of T482-0646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T482-0646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T482-0646
  • 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 T482-0646 available by request