T368-0118 Screening compound: 2-(phenylsulfanyl)-1-(3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidin-1-yl)ethan-1-one

T368-0118 Screening compound: 2-(phenylsulfanyl)-1-(3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidin-1-yl)ethan-1-one
T368-0118 Screening compound: 2-(phenylsulfanyl)-1-(3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T368-0118
2-(phenylsulfanyl)-1-(3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidin-1-yl)ethan-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

T368-0118

Molecular Formula

C21H24N4OS (C21 H24 N4 OS)

Compound Name

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

IUPAC name

2-(phenylsulfanyl)-1-(3-{2-propyl-3H-imidazo[45-b]pyridin-3-yl}pyrrolidin-1-yl)ethan-1-one

SMILES

CCCc1nc2cccnc2n1C(CC1)CN1C(CSc1ccccc1)=O

InChI

InChI=1S/C21H24N4OS/c1-2-7-19-23-18-10-6-12-22-21(18)25(19)16-11-13-24(14-16)20(26)15-27-17-8-4-3-5-9-17/h3-6,8-10,12,16H,2,7,11,13-15H2,1H3/t16-/m1/s1

InChI Key

CKRFHIVVZZZNHS-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD29023229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.404

Distribution Coefficient, logD

3.404

Water Solubility, LogSw

-3.58

Polar Surface Area

37.854

Acid Dissociation Constant (pKa)

19.00

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

T368-0118 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic
  • PPI modulators
Targets:
  • Kinases
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T368-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T368-0118?
Check Price and Availability of T368-0118, 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 T368-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T368-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T368-0118
  • 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 T368-0118 available by request