4275-2000 Screening compound: ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}phenyl)carbamoyl]propanoate

4275-2000 Screening compound: ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}phenyl)carbamoyl]propanoate
4275-2000 Screening compound: ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}phenyl)carbamoyl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4275-2000
ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}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

4275-2000

Molecular Formula

C25H30N2O6 (C25 H30 N2 O6)

Compound Name

ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}phenyl)carbamoyl]propanoate

IUPAC name

ethyl 3-[(4-{[4-(4-ethoxy-4-oxobutanamido)phenyl]methyl}phenyl)carbamoyl]propanoate

SMILES

CCOC(CCC(Nc1ccc(Cc(cc2)ccc2NC(CCC(OCC)=O)=O)cc1)=O)=O

InChI

InChI=1S/C25H30N2O6/c1-3-32-24(30)15-13-22(28)26-20-9-5-18(6-10-20)17-19-7-11-21(12-8-19)27-23(29)14-16-25(31)33-4-2/h5-12H,3-4,13-17H2,1-2H3,(H,26,28)(H,27,29)

InChI Key

OQQHHGFOBOHUFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02655594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.098

Distribution Coefficient, logD

3.098

Water Solubility, LogSw

-3.35

Polar Surface Area

86.583

Acid Dissociation Constant (pKa)

12.59

Base Dissociation Constant (pKb)

2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

4275-2000 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4275-2000 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4275-2000?
Check Price and Availability of 4275-2000, 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 4275-2000 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4275-2000
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4275-2000
  • 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 4275-2000 available by request