T633-1345 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-(furan-3-carbonyl)piperidine

T633-1345 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-(furan-3-carbonyl)piperidine
T633-1345 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-(furan-3-carbonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T633-1345
3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-(furan-3-carbonyl)piperidine

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

T633-1345

Molecular Formula

C19H20N4O2 (C19 H20 N4 O2)

Compound Name

3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-(furan-3-carbonyl)piperidine

IUPAC name

3-(4-benzyl-4H-124-triazol-3-yl)-1-(furan-3-carbonyl)piperidine

SMILES

O=C(c1cocc1)N(CCC1)CC1c1nncn1Cc1ccccc1

InChI

InChI=1S/C19H20N4O2/c24-19(17-8-10-25-13-17)22-9-4-7-16(12-22)18-21-20-14-23(18)11-15-5-2-1-3-6-15/h1-3,5-6,8,10,13-14,16H,4,7,9,11-12H2/t16-/m0/s1

InChI Key

LWKVSQIWGZYVHR-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27622730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.845

Distribution Coefficient, logD

1.845

Water Solubility, LogSw

-1.92

Polar Surface Area

48.708

Acid Dissociation Constant (pKa)

20.18

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

T633-1345 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Immunological Library (6760 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
Targets:
  • Others

References: we are preparing a list of scientific research reports with T633-1345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T633-1345?
Check Price and Availability of T633-1345, 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 T633-1345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T633-1345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T633-1345
  • 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 T633-1345 available by request