J006-0565 Screening compound: 4-{[2-methoxy-5-({2-[5-(propan-2-yl)-1,2-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine

J006-0565 Screening compound: 4-{[2-methoxy-5-({2-[5-(propan-2-yl)-1,2-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine
J006-0565 Screening compound: 4-{[2-methoxy-5-({2-[5-(propan-2-yl)-1,2-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound J006-0565
4-{[2-methoxy-5-({2-[5-(propan-2-yl)-1,2-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine

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

J006-0565

Molecular Formula

C23H33N3O3 (C23 H33 N3 O3)

Compound Name

4-{[2-methoxy-5-({2-[5-(propan-2-yl)-1,2-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine

IUPAC name

4-{[2-methoxy-5-({2-[5-(propan-2-yl)-12-oxazol-3-yl]pyrrolidin-1-yl}methyl)phenyl]methyl}morpholine

SMILES

CC(C)c1cc(C2N(Cc(cc3)cc(CN4CCOCC4)c3OC)CCC2)no1

InChI

InChI=1S/C23H33N3O3/c1-17(2)23-14-20(24-29-23)21-5-4-8-26(21)15-18-6-7-22(27-3)19(13-18)16-25-9-11-28-12-10-25/h6-7,13-14,17,21H,4-5,8-12,15-16H2,1-3H3/t21-/m0/s1

InChI Key

PBUWKUZFMVVNAG-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27215518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.272

Distribution Coefficient, logD

1.062

Water Solubility, LogSw

-3.08

Polar Surface Area

45.003

Acid Dissociation Constant (pKa)

24.20

Base Dissociation Constant (pKb)

9.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.90

J006-0565 in Drug Discovery

Included in Screening Libraries

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

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with J006-0565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J006-0565?
Check Price and Availability of J006-0565, 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 J006-0565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J006-0565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J006-0565
  • 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 J006-0565 available by request