T633-1121 Screening compound: 1-[3-(4-methyl-4H-1,2,4-triazol-3-yl)piperidino]-3-phenyl-1-propanone

T633-1121 Screening compound: 1-[3-(4-methyl-4H-1,2,4-triazol-3-yl)piperidino]-3-phenyl-1-propanone
T633-1121 Screening compound: 1-[3-(4-methyl-4H-1,2,4-triazol-3-yl)piperidino]-3-phenyl-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T633-1121
1-[3-(4-methyl-4H-1,2,4-triazol-3-yl)piperidino]-3-phenyl-1-propanone

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

T633-1121

Molecular Formula

C17H22N4O (C17 H22 N4 O)

Compound Name

1-[3-(4-methyl-4H-1,2,4-triazol-3-yl)piperidino]-3-phenyl-1-propanone

IUPAC name

1-[3-(4-methyl-4H-124-triazol-3-yl)piperidin-1-yl]-3-phenylpropan-1-one

SMILES

Cn1c(C(CCC2)CN2C(CCc2ccccc2)=O)nnc1

InChI

InChI=1S/C17H22N4O/c1-20-13-18-19-17(20)15-8-5-11-21(12-15)16(22)10-9-14-6-3-2-4-7-14/h2-4,6-7,13,15H,5,8-12H2,1H3/t15-/m0/s1

InChI Key

FIBWYAOGZDRHHP-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD13539808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.39

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

1.592

Distribution Coefficient, logD

1.592

Water Solubility, LogSw

-1.64

Polar Surface Area

41.205

Acid Dissociation Constant (pKa)

22.97

Base Dissociation Constant (pKb)

6.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.06

T633-1121 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T633-1121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T633-1121?
Check Price and Availability of T633-1121, 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 T633-1121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T633-1121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T633-1121
  • 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 T633-1121 available by request