D481-1753 Screening compound: 1-benzoyl-3-phenyl-1H-1,2,4-triazol-5-amine

D481-1753 Screening compound: 1-benzoyl-3-phenyl-1H-1,2,4-triazol-5-amine
D481-1753 Screening compound: 1-benzoyl-3-phenyl-1H-1,2,4-triazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-1753
1-benzoyl-3-phenyl-1H-1,2,4-triazol-5-amine

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

D481-1753

Molecular Formula

C15H12N4O (C15 H12 N4 O)

Compound Name

1-benzoyl-3-phenyl-1H-1,2,4-triazol-5-amine

IUPAC name

1-benzoyl-3-phenyl-1H-124-triazol-5-amine

SMILES

Nc1nc(-c2ccccc2)nn1C(c1ccccc1)=O

InChI

InChI=1S/C15H12N4O/c16-15-17-13(11-7-3-1-4-8-11)18-19(15)14(20)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18)

InChI Key

FGPIRFBZOFBCBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04147795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.397

Distribution Coefficient, logD

2.397

Water Solubility, LogSw

-2.58

Polar Surface Area

57.847

Acid Dissociation Constant (pKa)

19.63

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

D481-1753 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with D481-1753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-1753?
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What is the minimum amount of D481-1753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-1753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-1753
  • 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 D481-1753 available by request