T427-0983 Screening compound: 4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine

T427-0983 Screening compound: 4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine
T427-0983 Screening compound: 4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T427-0983
4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine

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

T427-0983

Molecular Formula

C18H21ClN2O2S (C18 H21 ClN2 O2 S)

Compound Name

4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine

IUPAC name

4-(3-chlorobenzenesulfonyl)-1-methyl-2-(4-methylphenyl)piperazine

SMILES

Cc1ccc(C(C2)N(C)CCN2S(c2cccc(Cl)c2)(=O)=O)cc1

InChI

InChI=1S/C18H21ClN2O2S/c1-14-6-8-15(9-7-14)18-13-21(11-10-20(18)2)24(22,23)17-5-3-4-16(19)12-17/h3-9,12,18H,10-11,13H2,1-2H3/t18-/m0/s1

InChI Key

NOALJVYPSLVHOG-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27621071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.547

Distribution Coefficient, logD

3.519

Water Solubility, LogSw

-3.90

Polar Surface Area

34.998

Acid Dissociation Constant (pKa)

26.87

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

T427-0983 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T427-0983 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T427-0983?
Check Price and Availability of T427-0983, 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 T427-0983 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T427-0983
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T427-0983
  • 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 T427-0983 available by request