6623-2028 Screening compound: benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate

6623-2028 Screening compound: benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate
6623-2028 Screening compound: benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-2028
benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate

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

6623-2028

Molecular Formula

C25H29N3O7 (C25 H29 N3 O7)

Compound Name

benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate

IUPAC name

benzyl 1-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)propanoyl]-4-hydroxypyrrolidine-2-carboxylate

SMILES

CC(C(N(CC(C1)O)C1C(OCc1ccccc1)=O)=O)NC(CNC(OCc1ccccc1)=O)=O

InChI

InChI=1S/C25H29N3O7/c1-17(27-22(30)13-26-25(33)35-16-19-10-6-3-7-11-19)23(31)28-14-20(29)12-21(28)24(32)34-15-18-8-4-2-5-9-18/h2-11,17,20-21,29H,12-16H2,1H3,(H,26,33)(H,27,30)

InChI Key

WSENEVDQXCUGGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00321075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.52

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.187

Distribution Coefficient, logD

2.187

Water Solubility, LogSw

-2.50

Polar Surface Area

110.236

Acid Dissociation Constant (pKa)

13.41

Base Dissociation Constant (pKb)

-0.66

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

36.00

6623-2028 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 6623-2028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-2028?
Check Price and Availability of 6623-2028, 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 6623-2028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-2028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-2028
  • 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 6623-2028 available by request