2260-4787 Screening compound: N~4~,N~4~-diethyl-5-methyl-3-phenyl-4-isoxazolecarboxamide

2260-4787 Screening compound: N~4~,N~4~-diethyl-5-methyl-3-phenyl-4-isoxazolecarboxamide
2260-4787 Screening compound: N~4~,N~4~-diethyl-5-methyl-3-phenyl-4-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2260-4787
N~4~,N~4~-diethyl-5-methyl-3-phenyl-4-isoxazolecarboxamide

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

2260-4787

Molecular Formula

C15H18N2O2 (C15 H18 N2 O2)

Compound Name

N~4~,N~4~-diethyl-5-methyl-3-phenyl-4-isoxazolecarboxamide

IUPAC name

NN-diethyl-5-methyl-3-phenyl-12-oxazole-4-carboxamide

SMILES

CCN(CC)C(c1c(C)onc1-c1ccccc1)=O

InChI

InChI=1S/C15H18N2O2/c1-4-17(5-2)15(18)13-11(3)19-16-14(13)12-9-7-6-8-10-12/h6-10H,4-5H2,1-3H3

InChI Key

AZRLAJOTOPTUOH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.191

Distribution Coefficient, logD

2.191

Water Solubility, LogSw

-2.22

Polar Surface Area

38.131

Acid Dissociation Constant (pKa)

27.51

Base Dissociation Constant (pKb)

6.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

2260-4787 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2260-4787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2260-4787?
Check Price and Availability of 2260-4787, 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 2260-4787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2260-4787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2260-4787
  • 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 2260-4787 available by request