P113-1261 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-dimethyl-1,3-thiazole-4-carboxamide

P113-1261 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-dimethyl-1,3-thiazole-4-carboxamide
P113-1261 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-dimethyl-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P113-1261
2-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-dimethyl-1,3-thiazole-4-carboxamide

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

P113-1261

Molecular Formula

C16H19ClN4OS (C16 H19 ClN4 OS)

Compound Name

2-[4-(3-chlorophenyl)piperazin-1-yl]-N,N-dimethyl-1,3-thiazole-4-carboxamide

IUPAC name

2-[4-(3-chlorophenyl)piperazin-1-yl]-NN-dimethyl-13-thiazole-4-carboxamide

SMILES

CN(C)C(c1csc(N(CC2)CCN2c2cccc(Cl)c2)n1)=O

InChI

InChI=1S/C16H19ClN4OS/c1-19(2)15(22)14-11-23-16(18-14)21-8-6-20(7-9-21)13-5-3-4-12(17)10-13/h3-5,10-11H,6-9H2,1-2H3

InChI Key

TZICORPEMMYTOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27565290

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.830

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.38

Polar Surface Area

32.772

Acid Dissociation Constant (pKa)

23.18

Base Dissociation Constant (pKb)

5.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

P113-1261 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with P113-1261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P113-1261?
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What is the minimum amount of P113-1261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P113-1261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P113-1261
  • 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 P113-1261 available by request