4483-1896 Screening compound: 2-(4-METHYLPHENYL)-2-OXOETHYL 2-(3

4483-1896 Screening compound: 2-(4-METHYLPHENYL)-2-OXOETHYL 2-(3
4483-1896 Screening compound: 2-(4-METHYLPHENYL)-2-OXOETHYL 2-(3 alternative view

Chemical Structure Depiction of ChemDiv screening compound 4483-1896
2-(4-METHYLPHENYL)-2-OXOETHYL 2-(3

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

4483-1896

Molecular Formula

C23H25NO5 (C23 H25 NO5)

Compound Name

2-(4-METHYLPHENYL)-2-OXOETHYL 2-(3

IUPAC name

n/a

SMILES

CC(C)C(C(OCC(c1ccc(C)cc1)=O)=O)N(C(C1C2C3C=CC1C3)=O)C2=O

InChI

InChI=1S/C23H25NO5/c1-12(2)20(23(28)29-11-17(25)14-6-4-13(3)5-7-14)24-21(26)18-15-8-9-16(10-15)19(18)22(24)27/h4-9,12,15-16,18-20H,10-11H2,1-3H3

InChI Key

WDTQHPVAXAGVJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01174836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.771

Distribution Coefficient, logD

2.771

Water Solubility, LogSw

-3.04

Polar Surface Area

63.673

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

-8.38

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

47.80

4483-1896 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 4483-1896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4483-1896?
Check Price and Availability of 4483-1896, 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 4483-1896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4483-1896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4483-1896
  • 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 4483-1896 available by request