L162-0232 Screening compound: 1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-carboxamide

L162-0232 Screening compound: 1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-carboxamide
L162-0232 Screening compound: 1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L162-0232
1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-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

L162-0232

Molecular Formula

C26H25ClN4OS (C26 H25 ClN4 OS)

Compound Name

1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-carboxamide

IUPAC name

1-[4-(4-chlorophenyl)piperazin-1-yl]-N-[2-(thiophen-2-yl)ethyl]isoquinoline-7-carboxamide

SMILES

O=C(c1ccc(ccnc2N(CC3)CCN3c(cc3)ccc3Cl)c2c1)NCCc1cccs1

InChI

InChI=1S/C26H25ClN4OS/c27-21-5-7-22(8-6-21)30-13-15-31(16-14-30)25-24-18-20(4-3-19(24)9-11-28-25)26(32)29-12-10-23-2-1-17-33-23/h1-9,11,17-18H,10,12-16H2,(H,29,32)

InChI Key

NRTNAELJFHRACV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27235211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.03

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.539

Distribution Coefficient, logD

5.525

Water Solubility, LogSw

-6.12

Polar Surface Area

40.934

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

L162-0232 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

GPCR Targeted Library (31838 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with L162-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L162-0232?
Check Price and Availability of L162-0232, 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 L162-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L162-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L162-0232
  • 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 L162-0232 available by request