T829-1767 Screening compound: methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate

T829-1767 Screening compound: methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate
T829-1767 Screening compound: methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound T829-1767
methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate

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

T829-1767

Molecular Formula

C22H25FN2O4 (C22 H25 FN2 O4)

Compound Name

methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H,5H,6H,7H-furo[3,2-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate

IUPAC name

methyl 1-{5-[(3-fluorophenyl)methyl]-2-methyl-4H5H6H7H-furo[32-c]pyridine-3-carbonyl}pyrrolidine-2-carboxylate

SMILES

Cc1c(C(N(CCC2)C2C(OC)=O)=O)c(CN(Cc2cccc(F)c2)CC2)c2o1

InChI

InChI=1S/C22H25FN2O4/c1-14-20(21(26)25-9-4-7-18(25)22(27)28-2)17-13-24(10-8-19(17)29-14)12-15-5-3-6-16(23)11-15/h3,5-6,11,18H,4,7-10,12-13H2,1-2H3/t18-/m0/s1

InChI Key

CIIPZNXZFFOZKA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD28995069

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.409

Distribution Coefficient, logD

-2.066

Water Solubility, LogSw

-2.55

Polar Surface Area

49.742

Acid Dissociation Constant (pKa)

18.58

Base Dissociation Constant (pKb)

11.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

T829-1767 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Integrin Receptors Targeted library (1715 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with T829-1767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T829-1767?
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What is the minimum amount of T829-1767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T829-1767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T829-1767
  • 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 T829-1767 available by request