D264-0824 Screening compound: ethyl 4-[({2-[2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate

D264-0824 Screening compound: ethyl 4-[({2-[2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate
D264-0824 Screening compound: ethyl 4-[({2-[2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D264-0824
ethyl 4-[({2-[2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate

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

D264-0824

Molecular Formula

C21H23N3O6 (C21 H23 N3 O6)

Compound Name

ethyl 4-[({2-[2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate

IUPAC name

ethyl 4-[({2-[2-(2-oxo-23-dihydro-13-benzoxazol-3-yl)ethoxy]ethyl}carbamoyl)amino]benzoate

SMILES

CCOC(c(cc1)ccc1NC(NCCOCCN(c(cccc1)c1O1)C1=O)=O)=O

InChI

InChI=1S/C21H23N3O6/c1-2-29-19(25)15-7-9-16(10-8-15)23-20(26)22-11-13-28-14-12-24-17-5-3-4-6-18(17)30-21(24)27/h3-10H,2,11-14H2,1H3,(H2,22,23,26)

InChI Key

HORSZEDLOUMIFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.163

Distribution Coefficient, logD

3.163

Water Solubility, LogSw

-3.59

Polar Surface Area

85.809

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D264-0824 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D264-0824 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D264-0824?
Check Price and Availability of D264-0824, 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 D264-0824 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D264-0824
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D264-0824
  • 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 D264-0824 available by request