4073-0099 Screening compound: 5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-1H-1,2,4-triazole

4073-0099 Screening compound: 5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-1H-1,2,4-triazole
4073-0099 Screening compound: 5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-1H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4073-0099
5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-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

4073-0099

Molecular Formula

C14H8BrFN4O2 (C14 H8 BrFN4 O2)

Compound Name

5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-1H-1,2,4-triazole

IUPAC name

5-(4-bromophenyl)-1-(4-fluoro-3-nitrophenyl)-1H-124-triazole

SMILES

[O-][N+](c(cc(cc1)-n2ncnc2-c(cc2)ccc2Br)c1F)=O

InChI

InChI=1S/C14H8BrFN4O2/c15-10-3-1-9(2-4-10)14-17-8-18-19(14)11-5-6-12(16)13(7-11)20(21)22/h1-8H

InChI Key

FSKQPPHNBVIBLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.15

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.258

Distribution Coefficient, logD

4.258

Water Solubility, LogSw

-4.65

Polar Surface Area

57.911

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4073-0099 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4073-0099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4073-0099?
Check Price and Availability of 4073-0099, 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 4073-0099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4073-0099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4073-0099
  • 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 4073-0099 available by request