T835-1404 Screening compound: 1-(3-{[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one

T835-1404 Screening compound: 1-(3-{[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one
T835-1404 Screening compound: 1-(3-{[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T835-1404
1-(3-{[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one

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

T835-1404

Molecular Formula

C17H24N4O (C17 H24 N4 O)

Compound Name

1-(3-{[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one

IUPAC name

1-(3-{[3-(propan-2-yl)-3H-imidazo[45-b]pyridin-2-yl]methyl}pyrrolidin-1-yl)propan-1-one

SMILES

CCC(N1CC(Cc(n2C(C)C)nc3c2nccc3)CC1)=O

InChI

InChI=1S/C17H24N4O/c1-4-16(22)20-9-7-13(11-20)10-15-19-14-6-5-8-18-17(14)21(15)12(2)3/h5-6,8,12-13H,4,7,9-11H2,1-3H3/t13-/m0/s1

InChI Key

HXKOUZLWJGCJMS-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD28121549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.383

Distribution Coefficient, logD

2.383

Water Solubility, LogSw

-2.44

Polar Surface Area

38.817

Acid Dissociation Constant (pKa)

18.65

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.82

T835-1404 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 T835-1404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T835-1404?
Check Price and Availability of T835-1404, 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 T835-1404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T835-1404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T835-1404
  • 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 T835-1404 available by request