Y031-7926 Screening compound: N,N,N,N-tetrabenzylterephthalamide

Y031-7926 Screening compound: N,N,N,N-tetrabenzylterephthalamide
Y031-7926 Screening compound: N,N,N,N-tetrabenzylterephthalamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7926
N,N,N,N-tetrabenzylterephthalamide

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

Y031-7926

Molecular Formula

C36H32N2O2 (C36 H32 N2 O2)

Compound Name

N,N,N,N-tetrabenzylterephthalamide

IUPAC name

N1N1N4N4-tetrabenzylbenzene-14-dicarboxamide

SMILES

O=C(c(cc1)ccc1C(N(Cc1ccccc1)Cc1ccccc1)=O)N(Cc1ccccc1)Cc1ccccc1

InChI

InChI=1S/C36H32N2O2/c39-35(37(25-29-13-5-1-6-14-29)26-30-15-7-2-8-16-30)33-21-23-34(24-22-33)36(40)38(27-31-17-9-3-10-18-31)28-32-19-11-4-12-20-32/h1-24H,25-28H2

InChI Key

RTPHIFXDMMPTQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00517332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.66

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.961

Distribution Coefficient, logD

5.961

Water Solubility, LogSw

-6.01

Polar Surface Area

32.117

Acid Dissociation Constant (pKa)

27.20

Base Dissociation Constant (pKb)

-6.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

Y031-7926 in Drug Discovery

Included in Screening Libraries

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

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with Y031-7926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7926?
Check Price and Availability of Y031-7926, 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 Y031-7926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7926
  • 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 Y031-7926 available by request