G790-0239 Screening compound: methyl 5-{[2-(1-cyclohexenyl)ethyl]amino}-3-(4-fluorophenyl)-4-isoxazolecarboxylate

G790-0239 Screening compound: methyl 5-{[2-(1-cyclohexenyl)ethyl]amino}-3-(4-fluorophenyl)-4-isoxazolecarboxylate
G790-0239 Screening compound: methyl 5-{[2-(1-cyclohexenyl)ethyl]amino}-3-(4-fluorophenyl)-4-isoxazolecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G790-0239
methyl 5-{[2-(1-cyclohexenyl)ethyl]amino}-3-(4-fluorophenyl)-4-isoxazolecarboxylate

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

G790-0239

Molecular Formula

C19H21FN2O3 (C19 H21 FN2 O3)

Compound Name

methyl 5-{[2-(1-cyclohexenyl)ethyl]amino}-3-(4-fluorophenyl)-4-isoxazolecarboxylate

IUPAC name

methyl 5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-3-(4-fluorophenyl)-12-oxazole-4-carboxylate

SMILES

COC(c1c(NCCC2=CCCCC2)onc1-c(cc1)ccc1F)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.762

Distribution Coefficient, logD

3.762

Water Solubility, LogSw

-4.23

Polar Surface Area

54.267

Acid Dissociation Constant (pKa)

16.34

Base Dissociation Constant (pKb)

-3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

G790-0239 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G790-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G790-0239?
Check Price and Availability of G790-0239, 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 G790-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G790-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G790-0239
  • 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 G790-0239 available by request