J006-2467 Screening compound: 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol

J006-2467 Screening compound: 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol
J006-2467 Screening compound: 4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound J006-2467
4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol

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

J006-2467

Molecular Formula

C17H22N2O3 (C17 H22 N2 O3)

Compound Name

4-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol

IUPAC name

4-{[2-(35-dimethyl-12-oxazol-4-yl)pyrrolidin-1-yl]methyl}-2-methoxyphenol

SMILES

Cc1noc(C)c1C1N(Cc(cc2)cc(OC)c2O)CCC1

InChI

InChI=1S/C17H22N2O3/c1-11-17(12(2)22-18-11)14-5-4-8-19(14)10-13-6-7-15(20)16(9-13)21-3/h6-7,9,14,20H,4-5,8,10H2,1-3H3/t14-/m0/s1

InChI Key

HURITUKWHQUYQE-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27215779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.918

Distribution Coefficient, logD

-1.090

Water Solubility, LogSw

-1.94

Polar Surface Area

50.142

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

10.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.10

J006-2467 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antifungal Library (16415 compounds)

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with J006-2467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J006-2467?
Check Price and Availability of J006-2467, 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 J006-2467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J006-2467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J006-2467
  • 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 J006-2467 available by request