4606-2652 Screening compound: N-(2-ethylhexyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

4606-2652 Screening compound: N-(2-ethylhexyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
4606-2652 Screening compound: N-(2-ethylhexyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4606-2652
N-(2-ethylhexyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

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

4606-2652

Molecular Formula

C19H26N2O2 (C19 H26 N2 O2)

Compound Name

N-(2-ethylhexyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

IUPAC name

N-(2-ethylhexyl)-5-methyl-3-phenyl-12-oxazole-4-carboxamide

SMILES

CCCCC(CC)CNC(c1c(C)onc1-c1ccccc1)=O

InChI

InChI=1S/C19H26N2O2/c1-4-6-10-15(5-2)13-20-19(22)17-14(3)23-21-18(17)16-11-8-7-9-12-16/h7-9,11-12,15H,4-6,10,13H2,1-3H3,(H,20,22)/t15-/m0/s1

InChI Key

CFFMQZLRMNKILT-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01356708

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.50

Polar Surface Area

46.883

Acid Dissociation Constant (pKa)

14.08

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.40

4606-2652 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4606-2652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4606-2652?
Check Price and Availability of 4606-2652, 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 4606-2652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4606-2652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4606-2652
  • 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 4606-2652 available by request