F235-0889 Screening compound: 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole

F235-0889 Screening compound: 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole
F235-0889 Screening compound: 5-methyl-1-(4-nitrophenyl)-1H-1,2,3-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-0889
5-methyl-1-(4-nitrophenyl)-1H-1,2,3-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

F235-0889

Molecular Formula

C9H8N4O2 (C9 H8 N4 O2)

Compound Name

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

IUPAC name

5-methyl-1-(4-nitrophenyl)-1H-123-triazole

SMILES

Cc1cnnn1-c(cc1)ccc1[N+]([O-])=O

InChI

InChI=1S/C9H8N4O2/c1-7-6-10-11-12(7)8-2-4-9(5-3-8)13(14)15/h2-6H,1H3

InChI Key

LNNFWMOIJXTSKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01222437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

204.19

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.634

Distribution Coefficient, logD

1.634

Water Solubility, LogSw

-1.63

Polar Surface Area

60.846

Acid Dissociation Constant (pKa)

23.26

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

F235-0889 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 F235-0889 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-0889?
Check Price and Availability of F235-0889, 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 F235-0889 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-0889
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-0889
  • 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 F235-0889 available by request