J006-2283 Screening compound: 3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-1,2-oxazole

J006-2283 Screening compound: 3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-1,2-oxazole
J006-2283 Screening compound: 3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-1,2-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound J006-2283
3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-1,2-oxazole

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

J006-2283

Molecular Formula

C18H24N2O3 (C18 H24 N2 O3)

Compound Name

3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-1,2-oxazole

IUPAC name

3-{1-[(4-ethoxy-3-methoxyphenyl)methyl]pyrrolidin-2-yl}-5-methyl-12-oxazole

SMILES

CCOc(ccc(CN(CCC1)C1c1noc(C)c1)c1)c1OC

InChI

InChI=1S/C18H24N2O3/c1-4-22-17-8-7-14(11-18(17)21-3)12-20-9-5-6-16(20)15-10-13(2)23-19-15/h7-8,10-11,16H,4-6,9,12H2,1-3H3/t16-/m0/s1

InChI Key

XXBGETQLVZWFCH-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27215747

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.864

Distribution Coefficient, logD

0.979

Water Solubility, LogSw

-2.90

Polar Surface Area

39.994

Acid Dissociation Constant (pKa)

26.47

Base Dissociation Constant (pKb)

9.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

J006-2283 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with J006-2283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J006-2283?
Check Price and Availability of J006-2283, 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 J006-2283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J006-2283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J006-2283
  • 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 J006-2283 available by request