C301-5101 Screening compound: 2-phenyl-2-(phenylamino)-2,3-dihydro-1H-indene-1,3-dione

C301-5101 Screening compound: 2-phenyl-2-(phenylamino)-2,3-dihydro-1H-indene-1,3-dione
C301-5101 Screening compound: 2-phenyl-2-(phenylamino)-2,3-dihydro-1H-indene-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5101
2-phenyl-2-(phenylamino)-2,3-dihydro-1H-indene-1,3-dione

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

C301-5101

Molecular Formula

C21H15NO2 (C21 H15 NO2)

Compound Name

2-phenyl-2-(phenylamino)-2,3-dihydro-1H-indene-1,3-dione

IUPAC name

2-phenyl-2-(phenylamino)-23-dihydro-1H-indene-13-dione

SMILES

O=C(C1(c2ccccc2)Nc2ccccc2)c(cccc2)c2C1=O

InChI

InChI=1S/C21H15NO2/c23-19-17-13-7-8-14-18(17)20(24)21(19,15-9-3-1-4-10-15)22-16-11-5-2-6-12-16/h1-14,22H

InChI Key

QLLIFCAYEWDQMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00387375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.385

Distribution Coefficient, logD

4.385

Water Solubility, LogSw

-4.58

Polar Surface Area

37.133

Acid Dissociation Constant (pKa)

16.54

Base Dissociation Constant (pKb)

-6.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

C301-5101 in Drug Discovery

Included in Screening Libraries

Neuropeptide S Library (2850 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Nervous system
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • GPCR
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-5101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5101?
Check Price and Availability of C301-5101, 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 C301-5101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5101
  • 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 C301-5101 available by request