4483-3068 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate

4483-3068 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate
4483-3068 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4483-3068
2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate

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

4483-3068

Molecular Formula

C26H25NO6 (C26 H25 NO6)

Compound Name

2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate

IUPAC name

2-(4-methoxyphenyl)-2-oxoethyl 3-{[4-(2-methylphenoxy)phenyl]carbamoyl}propanoate

SMILES

Cc(cccc1)c1Oc(cc1)ccc1NC(CCC(OCC(c(cc1)ccc1OC)=O)=O)=O

InChI

InChI=1S/C26H25NO6/c1-18-5-3-4-6-24(18)33-22-13-9-20(10-14-22)27-25(29)15-16-26(30)32-17-23(28)19-7-11-21(31-2)12-8-19/h3-14H,15-17H2,1-2H3,(H,27,29)

InChI Key

KVOYTZKMLJZFBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02189205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.219

Distribution Coefficient, logD

4.219

Water Solubility, LogSw

-4.58

Polar Surface Area

71.276

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

2.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

4483-3068 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4483-3068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4483-3068?
Check Price and Availability of 4483-3068, 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 4483-3068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4483-3068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4483-3068
  • 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 4483-3068 available by request