T403-2169 Screening compound: 1-(1-{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine

T403-2169 Screening compound: 1-(1-{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine
T403-2169 Screening compound: 1-(1-{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T403-2169
1-(1-{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine

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

T403-2169

Molecular Formula

C17H23ClN6O (C17 H23 ClN6 O)

Compound Name

1-(1-{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine

IUPAC name

1-(1-{8-chloro-[124]triazolo[43-a]pyridin-3-yl}piperidine-4-carbonyl)-4-methylpiperazine

SMILES

CN(CC1)CCN1C(C(CC1)CCN1c1nnc2n1cccc2Cl)=O

InChI

InChI=1S/C17H23ClN6O/c1-21-9-11-22(12-10-21)16(25)13-4-7-23(8-5-13)17-20-19-15-14(18)3-2-6-24(15)17/h2-3,6,13H,4-5,7-12H2,1H3

InChI Key

WQZAWTXPPGSWEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28121253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.993

Distribution Coefficient, logD

0.645

Water Solubility, LogSw

-2.20

Polar Surface Area

45.513

Acid Dissociation Constant (pKa)

20.58

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

T403-2169 in Drug Discovery

Included in Screening Libraries

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

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 T403-2169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T403-2169?
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What is the minimum amount of T403-2169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T403-2169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T403-2169
  • 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 T403-2169 available by request