L895-0232 Screening compound: N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide

L895-0232 Screening compound: N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
L895-0232 Screening compound: N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L895-0232
N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-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

L895-0232

Molecular Formula

C21H26N4OS (C21 H26 N4 OS)

Compound Name

N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide

IUPAC name

N-cyclopentyl-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide

SMILES

O=C(C(CCC1)CN1c1nccnc1Sc1ccccc1)NC1CCCC1

InChI

InChI=1S/C21H26N4OS/c26-20(24-17-8-4-5-9-17)16-7-6-14-25(15-16)19-21(23-13-12-22-19)27-18-10-2-1-3-11-18/h1-3,10-13,16-17H,4-9,14-15H2,(H,24,26)/t16-/m0/s1

InChI Key

FWXWZZJDTOMJCQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD15136630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.719

Distribution Coefficient, logD

3.719

Water Solubility, LogSw

-3.99

Polar Surface Area

46.018

Acid Dissociation Constant (pKa)

15.49

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.60

L895-0232 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 L895-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L895-0232?
Check Price and Availability of L895-0232, 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 L895-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L895-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L895-0232
  • 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 L895-0232 available by request