T829-0884 Screening compound: N,2-dimethyl-5-(4-methylbenzyl)-N-propyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine-3-carboxamide

T829-0884 Screening compound: N,2-dimethyl-5-(4-methylbenzyl)-N-propyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine-3-carboxamide
T829-0884 Screening compound: N,2-dimethyl-5-(4-methylbenzyl)-N-propyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T829-0884
N,2-dimethyl-5-(4-methylbenzyl)-N-propyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine-3-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

T829-0884

Molecular Formula

C21H28N2O2 (C21 H28 N2 O2)

Compound Name

N,2-dimethyl-5-(4-methylbenzyl)-N-propyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine-3-carboxamide

IUPAC name

N2-dimethyl-5-[(4-methylphenyl)methyl]-N-propyl-4H5H6H7H-furo[32-c]pyridine-3-carboxamide

SMILES

CCCN(C)C(c1c(C)oc2c1CN(Cc1ccc(C)cc1)CC2)=O

InChI

InChI=1S/C21H28N2O2/c1-5-11-22(4)21(24)20-16(3)25-19-10-12-23(14-18(19)20)13-17-8-6-15(2)7-9-17/h6-9H,5,10-14H2,1-4H3

InChI Key

NLHRJZKGDNDWEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28995054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.188

Distribution Coefficient, logD

-2.089

Water Solubility, LogSw

-3.18

Polar Surface Area

28.261

Acid Dissociation Constant (pKa)

25.85

Base Dissociation Constant (pKb)

12.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.62

T829-0884 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with T829-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T829-0884?
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What is the minimum amount of T829-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T829-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T829-0884
  • 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 T829-0884 available by request