T835-2005 Screening compound: (3-{[3-(2-METHOXYETHYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]METHYL}-1-PYRROLIDINYL)(3-METHOXYPHENYL)METHANONE

T835-2005 Screening compound: (3-{[3-(2-METHOXYETHYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]METHYL}-1-PYRROLIDINYL)(3-METHOXYPHENYL)METHANONE
T835-2005 Screening compound: (3-{[3-(2-METHOXYETHYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]METHYL}-1-PYRROLIDINYL)(3-METHOXYPHENYL)METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T835-2005
(3-{[3-(2-METHOXYETHYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]METHYL}-1-PYRROLIDINYL)(3-METHOXYPHENYL)METHANONE

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

T835-2005

Molecular Formula

C22H26N4O3 (C22 H26 N4 O3)

Compound Name

(3-{[3-(2-METHOXYETHYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]METHYL}-1-PYRROLIDINYL)(3-METHOXYPHENYL)METHANONE

IUPAC name

n/a

SMILES

COCCn1c(nccc2)c2nc1CC(CC1)CN1C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C22H26N4O3/c1-28-12-11-26-20(24-19-7-4-9-23-21(19)26)13-16-8-10-25(15-16)22(27)17-5-3-6-18(14-17)29-2/h3-7,9,14,16H,8,10-13,15H2,1-2H3/t16-/m0/s1

InChI Key

RYGMQZHKAMQWSU-INIZCTEOSA-N

MDL Number (MFCD)

MFCD28121596

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.429

Distribution Coefficient, logD

2.429

Water Solubility, LogSw

-2.65

Polar Surface Area

53.862

Acid Dissociation Constant (pKa)

20.72

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

T835-2005 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 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 T835-2005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T835-2005?
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What is the minimum amount of T835-2005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T835-2005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T835-2005
  • 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 T835-2005 available by request