T829-0899 Screening compound: 1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}-1,4'-bipiperidine

T829-0899 Screening compound: 1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}-1,4'-bipiperidine
T829-0899 Screening compound: 1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}-1,4'-bipiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T829-0899
1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}-1,4'-bipiperidine

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

T829-0899

Molecular Formula

C27H37N3O2 (C27 H37 N3 O2)

Compound Name

1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}-1,4'-bipiperidine

IUPAC name

1'-{2-methyl-5-[(4-methylphenyl)methyl]-4H5H6H7H-furo[32-c]pyridine-3-carbonyl}-14'-bipiperidine

SMILES

Cc1c(C(N(CC2)CCC2N2CCCCC2)=O)c(CN(Cc2ccc(C)cc2)CC2)c2o1

InChI

InChI=1S/C27H37N3O2/c1-20-6-8-22(9-7-20)18-28-15-12-25-24(19-28)26(21(2)32-25)27(31)30-16-10-23(11-17-30)29-13-4-3-5-14-29/h6-9,23H,3-5,10-19H2,1-2H3

InChI Key

VQCGQWQCBZPZRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28995256

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.864

Distribution Coefficient, logD

-1.413

Water Solubility, LogSw

-4.14

Polar Surface Area

31.602

Acid Dissociation Constant (pKa)

25.85

Base Dissociation Constant (pKb)

12.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.30

T829-0899 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T829-0899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T829-0899?
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What is the minimum amount of T829-0899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T829-0899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T829-0899
  • 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 T829-0899 available by request