T368-1820 Screening compound: N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidine-1-carboxamide

T368-1820 Screening compound: N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidine-1-carboxamide
T368-1820 Screening compound: N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T368-1820
N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidine-1-carboxamide

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

T368-1820

Molecular Formula

C21H25N5OS (C21 H25 N5 OS)

Compound Name

N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[4,5-b]pyridin-3-yl}pyrrolidine-1-carboxamide

IUPAC name

N-[3-(methylsulfanyl)phenyl]-3-{2-propyl-3H-imidazo[45-b]pyridin-3-yl}pyrrolidine-1-carboxamide

SMILES

CCCc1nc2cccnc2n1C(CC1)CN1C(Nc1cccc(SC)c1)=O

InChI

InChI=1S/C21H25N5OS/c1-3-6-19-24-18-9-5-11-22-20(18)26(19)16-10-12-25(14-16)21(27)23-15-7-4-8-17(13-15)28-2/h4-5,7-9,11,13,16H,3,6,10,12,14H2,1-2H3,(H,23,27)/t16-/m1/s1

InChI Key

VVEUTNUUXLCKPO-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD29023304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.748

Distribution Coefficient, logD

3.748

Water Solubility, LogSw

-3.79

Polar Surface Area

47.203

Acid Dissociation Constant (pKa)

13.47

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

T368-1820 in Drug Discovery

Included in Screening Libraries

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
  • 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 T368-1820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T368-1820?
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What is the minimum amount of T368-1820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T368-1820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T368-1820
  • 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 T368-1820 available by request