6623-2085 Screening compound: ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate

6623-2085 Screening compound: ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate
6623-2085 Screening compound: ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-2085
ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate

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

6623-2085

Molecular Formula

C23H27N3O6 (C23 H27 N3 O6)

Compound Name

ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate

IUPAC name

ethyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]-3-phenylpropanoate

SMILES

CCOC(C(Cc1ccccc1)NC(CNC(CNC(OCc1ccccc1)=O)=O)=O)=O

InChI

InChI=1S/C23H27N3O6/c1-2-31-22(29)19(13-17-9-5-3-6-10-17)26-21(28)15-24-20(27)14-25-23(30)32-16-18-11-7-4-8-12-18/h3-12,19H,2,13-16H2,1H3,(H,24,27)(H,25,30)(H,26,28)/t19-/m0/s1

InChI Key

UYDGZNCZWFBICC-IBGZPJMESA-N

MDL Number (MFCD)

MFCD00331461

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.994

Distribution Coefficient, logD

2.994

Water Solubility, LogSw

-3.25

Polar Surface Area

102.435

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

6623-2085 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Proteases
  • Phosphatases

References: we are preparing a list of scientific research reports with 6623-2085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-2085?
Check Price and Availability of 6623-2085, 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 6623-2085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-2085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-2085
  • 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 6623-2085 available by request