1258-0015 Screening compound: 2-(acetyloxy)-1,2-bis(phenylcarbamoyl)ethyl acetate

1258-0015 Screening compound: 2-(acetyloxy)-1,2-bis(phenylcarbamoyl)ethyl acetate
1258-0015 Screening compound: 2-(acetyloxy)-1,2-bis(phenylcarbamoyl)ethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1258-0015
2-(acetyloxy)-1,2-bis(phenylcarbamoyl)ethyl 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

1258-0015

Molecular Formula

C20H20N2O6 (C20 H20 N2 O6)

Compound Name

2-(acetyloxy)-1,2-bis(phenylcarbamoyl)ethyl acetate

IUPAC name

2-(acetyloxy)-12-bis(phenylcarbamoyl)ethyl acetate

SMILES

CC(OC(C(C(Nc1ccccc1)=O)OC(C)=O)C(Nc1ccccc1)=O)=O

InChI

InChI=1S/C20H20N2O6/c1-13(23)27-17(19(25)21-15-9-5-3-6-10-15)18(28-14(2)24)20(26)22-16-11-7-4-8-12-16/h3-12,17-18H,1-2H3,(H,21,25)(H,22,26)

InChI Key

HDQCEBDIONAOIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01245068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.245

Distribution Coefficient, logD

1.245

Water Solubility, LogSw

-1.67

Polar Surface Area

87.707

Acid Dissociation Constant (pKa)

11.96

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 1258-0015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1258-0015?
Check Price and Availability of 1258-0015, 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 1258-0015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1258-0015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1258-0015
  • 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 1258-0015 available by request