T368-3333 Screening compound: 3-{2-methyl-3H-imidazo[4,5-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine

T368-3333 Screening compound: 3-{2-methyl-3H-imidazo[4,5-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine
T368-3333 Screening compound: 3-{2-methyl-3H-imidazo[4,5-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T368-3333
3-{2-methyl-3H-imidazo[4,5-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine

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

T368-3333

Molecular Formula

C14H20N4O2S (C14 H20 N4 O2 S)

Compound Name

3-{2-methyl-3H-imidazo[4,5-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine

IUPAC name

3-{2-methyl-3H-imidazo[45-b]pyridin-3-yl}-1-(propane-1-sulfonyl)pyrrolidine

SMILES

CCCS(N(CC1)CC1n1c2ncccc2nc1C)(=O)=O

InChI

InChI=1S/C14H20N4O2S/c1-3-9-21(19,20)17-8-6-12(10-17)18-11(2)16-13-5-4-7-15-14(13)18/h4-5,7,12H,3,6,8-10H2,1-2H3/t12-/m1/s1

InChI Key

ZOAUZUHKLHOJLQ-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD28121230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.988

Distribution Coefficient, logD

0.988

Water Solubility, LogSw

-1.91

Polar Surface Area

53.411

Acid Dissociation Constant (pKa)

18.36

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

T368-3333 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

CNS MPO Library (28609 compounds)

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T368-3333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T368-3333?
Check Price and Availability of T368-3333, 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 T368-3333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T368-3333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T368-3333
  • 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 T368-3333 available by request