2202-1116 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)propanoate

2202-1116 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)propanoate
2202-1116 Screening compound: 2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2202-1116
2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)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

2202-1116

Molecular Formula

C25H23NO5 (C25 H23 NO5)

Compound Name

2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)propanoate

IUPAC name

2-(4-methoxyphenyl)-2-oxoethyl 3-(diphenylcarbamoyl)propanoate

SMILES

COc(cc1)ccc1C(COC(CCC(N(c1ccccc1)c1ccccc1)=O)=O)=O

InChI

InChI=1S/C25H23NO5/c1-30-22-14-12-19(13-15-22)23(27)18-31-25(29)17-16-24(28)26(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-15H,16-18H2,1H3

InChI Key

NPWBLLYZELNPBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01174928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.538

Distribution Coefficient, logD

3.538

Water Solubility, LogSw

-3.74

Polar Surface Area

55.907

Acid Dissociation Constant (pKa)

20.87

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

2202-1116 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 2202-1116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2202-1116?
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What is the minimum amount of 2202-1116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2202-1116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2202-1116
  • 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 2202-1116 available by request