1442-0026 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl benzoate

1442-0026 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl benzoate
1442-0026 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1442-0026
2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl 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

1442-0026

Molecular Formula

C19H15NO5 (C19 H15 NO5)

Compound Name

2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl benzoate

IUPAC name

2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl benzoate

SMILES

O=C(C1=Cc(cccc2)c2OC1=O)NCCOC(c1ccccc1)=O

InChI

InChI=1S/C19H15NO5/c21-17(15-12-14-8-4-5-9-16(14)25-19(15)23)20-10-11-24-18(22)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,21)

InChI Key

DBOIQDRFIUREDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00377643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.888

Distribution Coefficient, logD

2.888

Water Solubility, LogSw

-3.42

Polar Surface Area

66.463

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

-1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

1442-0026 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 1442-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1442-0026?
Check Price and Availability of 1442-0026, 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 1442-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1442-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1442-0026
  • 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 1442-0026 available by request