8002-6270 Screening compound: (4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-4,5-dihydro-1,3-oxazol-5-one

8002-6270 Screening compound: (4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-4,5-dihydro-1,3-oxazol-5-one
8002-6270 Screening compound: (4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-6270
(4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-4,5-dihydro-1,3-oxazol-5-one

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

8002-6270

Molecular Formula

C33H37NO4 (C33 H37 NO4)

Compound Name

(4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-4-{[4-(benzyloxy)phenyl]methylidene}-2-[4-(decyloxy)phenyl]-45-dihydro-13-oxazol-5-one

SMILES

CCCCCCCCCCOc(cc1)ccc1C(OC1=O)=N/C1=C\c(cc1)ccc1OCc1ccccc1

InChI

InChI=1S/C33H37NO4/c1-2-3-4-5-6-7-8-12-23-36-29-21-17-28(18-22-29)32-34-31(33(35)38-32)24-26-15-19-30(20-16-26)37-25-27-13-10-9-11-14-27/h9-11,13-22,24H,2-8,12,23,25H2,1H3

InChI Key

UUPGAGLAHYQFKZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00733031

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

9.174

Distribution Coefficient, logD

9.174

Water Solubility, LogSw

-5.89

Polar Surface Area

45.021

Acid Dissociation Constant (pKa)

27.86

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8002-6270 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Nuclear receptors
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8002-6270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-6270?
Check Price and Availability of 8002-6270, 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 8002-6270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-6270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-6270
  • 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 8002-6270 available by request