4466-0215 Screening compound: 1,3-diacetyl-5-(acetyloxy)-2-oxo-4-imidazolidinyl acetate

4466-0215 Screening compound: 1,3-diacetyl-5-(acetyloxy)-2-oxo-4-imidazolidinyl acetate
4466-0215 Screening compound: 1,3-diacetyl-5-(acetyloxy)-2-oxo-4-imidazolidinyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4466-0215
1,3-diacetyl-5-(acetyloxy)-2-oxo-4-imidazolidinyl acetate

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

4466-0215

Molecular Formula

C11H14N2O7 (C11 H14 N2 O7)

Compound Name

1,3-diacetyl-5-(acetyloxy)-2-oxo-4-imidazolidinyl acetate

IUPAC name

13-diacetyl-5-(acetyloxy)-2-oxoimidazolidin-4-yl acetate

SMILES

CC(N(C(C(N1C(C)=O)OC(C)=O)OC(C)=O)C1=O)=O

InChI

InChI=1S/C11H14N2O7/c1-5(14)12-9(19-7(3)16)10(20-8(4)17)13(6(2)15)11(12)18/h9-10H,1-4H3

InChI Key

YFVKOCQCCWOKII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.24

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-1.252

Distribution Coefficient, logD

-1.252

Water Solubility, LogSw

0.10

Polar Surface Area

90.639

Acid Dissociation Constant (pKa)

22.87

Base Dissociation Constant (pKb)

-8.68

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

54.54

4466-0215 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4466-0215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4466-0215?
Check Price and Availability of 4466-0215, 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 4466-0215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4466-0215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4466-0215
  • 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 4466-0215 available by request