T427-1142 Screening compound: 4-{[3-(4-methoxyphenyl)-4-methylpiperazino]sulfonyl}benzonitrile

T427-1142 Screening compound: 4-{[3-(4-methoxyphenyl)-4-methylpiperazino]sulfonyl}benzonitrile
T427-1142 Screening compound: 4-{[3-(4-methoxyphenyl)-4-methylpiperazino]sulfonyl}benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound T427-1142
4-{[3-(4-methoxyphenyl)-4-methylpiperazino]sulfonyl}benzonitrile

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

T427-1142

Molecular Formula

C19H21N3O3S (C19 H21 N3 O3 S)

Compound Name

4-{[3-(4-methoxyphenyl)-4-methylpiperazino]sulfonyl}benzonitrile

IUPAC name

n/a

SMILES

CN(CCN(C1)S(c(cc2)ccc2C#N)(=O)=O)C1c(cc1)ccc1OC

InChI

InChI=1S/C19H21N3O3S/c1-21-11-12-22(14-19(21)16-5-7-17(25-2)8-6-16)26(23,24)18-9-3-15(13-20)4-10-18/h3-10,19H,11-12,14H2,1-2H3/t19-/m0/s1

InChI Key

FJTQDJQZBKPXRR-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27621096

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.166

Distribution Coefficient, logD

2.161

Water Solubility, LogSw

-2.55

Polar Surface Area

59.598

Acid Dissociation Constant (pKa)

26.87

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

T427-1142 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T427-1142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T427-1142?
Check Price and Availability of T427-1142, 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 T427-1142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T427-1142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T427-1142
  • 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 T427-1142 available by request