3257-0911 Screening compound: 2-oxo-2-phenylethyl 2-(phenylamino)benzoate

3257-0911 Screening compound: 2-oxo-2-phenylethyl 2-(phenylamino)benzoate
3257-0911 Screening compound: 2-oxo-2-phenylethyl 2-(phenylamino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-0911
2-oxo-2-phenylethyl 2-(phenylamino)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

3257-0911

Molecular Formula

C21H17NO3 (C21 H17 NO3)

Compound Name

2-oxo-2-phenylethyl 2-(phenylamino)benzoate

IUPAC name

2-oxo-2-phenylethyl 2-(phenylamino)benzoate

SMILES

O=C(COC(c(cccc1)c1Nc1ccccc1)=O)c1ccccc1

InChI

InChI=1S/C21H17NO3/c23-20(16-9-3-1-4-10-16)15-25-21(24)18-13-7-8-14-19(18)22-17-11-5-2-6-12-17/h1-14,22H,15H2

InChI Key

SMXZKDHWOXZJHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00690053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.693

Distribution Coefficient, logD

4.693

Water Solubility, LogSw

-4.81

Polar Surface Area

42.558

Acid Dissociation Constant (pKa)

17.98

Base Dissociation Constant (pKb)

-1.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

3257-0911 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 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:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 3257-0911 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-0911?
Check Price and Availability of 3257-0911, 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 3257-0911 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-0911
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-0911
  • 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 3257-0911 available by request