T632-2554 Screening compound: 4-(4-propyl-4H-1,2,4-triazol-3-yl)-1-(thiophene-3-carbonyl)piperidine

T632-2554 Screening compound: 4-(4-propyl-4H-1,2,4-triazol-3-yl)-1-(thiophene-3-carbonyl)piperidine
T632-2554 Screening compound: 4-(4-propyl-4H-1,2,4-triazol-3-yl)-1-(thiophene-3-carbonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T632-2554
4-(4-propyl-4H-1,2,4-triazol-3-yl)-1-(thiophene-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

T632-2554

Molecular Formula

C15H20N4OS (C15 H20 N4 OS)

Compound Name

4-(4-propyl-4H-1,2,4-triazol-3-yl)-1-(thiophene-3-carbonyl)piperidine

IUPAC name

4-(4-propyl-4H-124-triazol-3-yl)-1-(thiophene-3-carbonyl)piperidine

SMILES

CCCn1c(C(CC2)CCN2C(c2cscc2)=O)nnc1

InChI

InChI=1S/C15H20N4OS/c1-2-6-19-11-16-17-14(19)12-3-7-18(8-4-12)15(20)13-5-9-21-10-13/h5,9-12H,2-4,6-8H2,1H3

InChI Key

JQMUFKXXIDQTDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29028137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.578

Distribution Coefficient, logD

1.578

Water Solubility, LogSw

-2.07

Polar Surface Area

42.240

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

T632-2554 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with T632-2554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T632-2554?
Check Price and Availability of T632-2554, 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 T632-2554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T632-2554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T632-2554
  • 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 T632-2554 available by request