T842-2034 Screening compound: 2-{1-[(5-chloro-2-methoxyphenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-3-isobutyl-3H-imidazo[4,5-c]pyridine

T842-2034 Screening compound: 2-{1-[(5-chloro-2-methoxyphenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-3-isobutyl-3H-imidazo[4,5-c]pyridine
T842-2034 Screening compound: 2-{1-[(5-chloro-2-methoxyphenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-3-isobutyl-3H-imidazo[4,5-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound T842-2034
2-{1-[(5-chloro-2-methoxyphenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-3-isobutyl-3H-imidazo[4,5-c]pyridine

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

T842-2034

Molecular Formula

C21H25ClN4O3S (C21 H25 ClN4 O3 S)

Compound Name

2-{1-[(5-chloro-2-methoxyphenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-3-isobutyl-3H-imidazo[4,5-c]pyridine

IUPAC name

n/a

SMILES

CC(C)Cn1c(cncc2)c2nc1C(CC1)CN1S(c(cc(cc1)Cl)c1OC)(=O)=O

InChI

InChI=1S/C21H25ClN4O3S/c1-14(2)12-26-18-11-23-8-6-17(18)24-21(26)15-7-9-25(13-15)30(27,28)20-10-16(22)4-5-19(20)29-3/h4-6,8,10-11,14-15H,7,9,12-13H2,1-3H3/t15-/m1/s1

InChI Key

FFYNZXLUWUXHJV-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD28121816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.079

Distribution Coefficient, logD

4.078

Water Solubility, LogSw

-4.47

Polar Surface Area

59.326

Acid Dissociation Constant (pKa)

24.82

Base Dissociation Constant (pKb)

4.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

T842-2034 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T842-2034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T842-2034?
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What is the minimum amount of T842-2034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T842-2034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T842-2034
  • 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 T842-2034 available by request