T835-1661 Screening compound: 1-{3-[(3-ISOBUTYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL)METHYL]-1-PYRROLIDINYL}-2-(3-METHOXYPHENYL)-1-ETHANONE

T835-1661 Screening compound: 1-{3-[(3-ISOBUTYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL)METHYL]-1-PYRROLIDINYL}-2-(3-METHOXYPHENYL)-1-ETHANONE
T835-1661 Screening compound: 1-{3-[(3-ISOBUTYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL)METHYL]-1-PYRROLIDINYL}-2-(3-METHOXYPHENYL)-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T835-1661
1-{3-[(3-ISOBUTYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL)METHYL]-1-PYRROLIDINYL}-2-(3-METHOXYPHENYL)-1-ETHANONE

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

T835-1661

Molecular Formula

C24H30N4O2 (C24 H30 N4 O2)

Compound Name

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

IUPAC name

n/a

SMILES

CC(C)Cn1c(nccc2)c2nc1CC(CC1)CN1C(Cc1cc(OC)ccc1)=O

InChI

InChI=1S/C24H30N4O2/c1-17(2)15-28-22(26-21-8-5-10-25-24(21)28)13-19-9-11-27(16-19)23(29)14-18-6-4-7-20(12-18)30-3/h4-8,10,12,17,19H,9,11,13-16H2,1-3H3/t19-/m0/s1

InChI Key

HLQMOMLTVQOMOZ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27624180

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.182

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.41

Polar Surface Area

45.014

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

T835-1661 in Drug Discovery

Included in Screening Libraries

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

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 T835-1661 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T835-1661?
Check Price and Availability of T835-1661, 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 T835-1661 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T835-1661
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T835-1661
  • 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 T835-1661 available by request