D351-2268 Screening compound: 1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-1,2,4-triazole

D351-2268 Screening compound: 1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-1,2,4-triazole
D351-2268 Screening compound: 1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D351-2268
1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-1,2,4-triazole

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

D351-2268

Molecular Formula

C20H20N4O (C20 H20 N4 O)

Compound Name

1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-1,2,4-triazole

IUPAC name

1-(4-methylphenyl)-5-phenyl-3-(pyrrolidine-1-carbonyl)-1H-124-triazole

SMILES

Cc(cc1)ccc1-n1nc(C(N2CCCC2)=O)nc1-c1ccccc1

InChI

InChI=1S/C20H20N4O/c1-15-9-11-17(12-10-15)24-19(16-7-3-2-4-8-16)21-18(22-24)20(25)23-13-5-6-14-23/h2-4,7-12H,5-6,13-14H2,1H3

InChI Key

AHBVUFGJZSXDTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07606550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.134

Distribution Coefficient, logD

4.134

Water Solubility, LogSw

-4.04

Polar Surface Area

40.903

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D351-2268 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Targeted Diversity Library (40567 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with D351-2268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D351-2268?
Check Price and Availability of D351-2268, 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 D351-2268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D351-2268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D351-2268
  • 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 D351-2268 available by request