D481-1988 Screening compound: 1-benzoyl-3-(4-chlorophenyl)-1H-1,2,4-triazol-5-amine

D481-1988 Screening compound: 1-benzoyl-3-(4-chlorophenyl)-1H-1,2,4-triazol-5-amine
D481-1988 Screening compound: 1-benzoyl-3-(4-chlorophenyl)-1H-1,2,4-triazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-1988
1-benzoyl-3-(4-chlorophenyl)-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

D481-1988

Molecular Formula

C15H11ClN4O (C15 H11 ClN4 O)

Compound Name

1-benzoyl-3-(4-chlorophenyl)-1H-1,2,4-triazol-5-amine

IUPAC name

1-benzoyl-3-(4-chlorophenyl)-1H-124-triazol-5-amine

SMILES

Nc1nc(-c(cc2)ccc2Cl)nn1C(c1ccccc1)=O

InChI

InChI=1S/C15H11ClN4O/c16-12-8-6-10(7-9-12)13-18-15(17)20(19-13)14(21)11-4-2-1-3-5-11/h1-9H,(H2,17,18,19)

InChI Key

FTVMGMKQIPQZHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27588990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.73

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

3.097

Distribution Coefficient, logD

3.097

Water Solubility, LogSw

-3.54

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

D481-1988 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D481-1988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-1988?
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What is the minimum amount of D481-1988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-1988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-1988
  • 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 D481-1988 available by request