T835-1826 Screening compound: 1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole

T835-1826 Screening compound: 1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole
T835-1826 Screening compound: 1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound T835-1826
1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole

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

T835-1826

Molecular Formula

C21H28N6O (C21 H28 N6 O)

Compound Name

1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole

IUPAC name

1-ethyl-3-(3-{[3-(2-methylpropyl)-3H-imidazo[45-b]pyridin-2-yl]methyl}pyrrolidine-1-carbonyl)-1H-pyrazole

SMILES

CCn(cc1)nc1C(N1CC(Cc(n2CC(C)C)nc3c2nccc3)CC1)=O

InChI

InChI=1S/C21H28N6O/c1-4-26-11-8-18(24-26)21(28)25-10-7-16(14-25)12-19-23-17-6-5-9-22-20(17)27(19)13-15(2)3/h5-6,8-9,11,15-16H,4,7,10,12-14H2,1-3H3/t16-/m0/s1

InChI Key

PTBFBQCFKLJRCP-INIZCTEOSA-N

MDL Number (MFCD)

MFCD28121578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.705

Distribution Coefficient, logD

2.705

Water Solubility, LogSw

-2.67

Polar Surface Area

52.383

Acid Dissociation Constant (pKa)

21.72

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.40

T835-1826 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

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

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T835-1826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T835-1826?
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What is the minimum amount of T835-1826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T835-1826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T835-1826
  • 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 T835-1826 available by request