L895-0310 Screening compound: N-(3-ethoxypropyl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide

L895-0310 Screening compound: N-(3-ethoxypropyl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
L895-0310 Screening compound: N-(3-ethoxypropyl)-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L895-0310
N-(3-ethoxypropyl)-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

L895-0310

Molecular Formula

C21H28N4O2S (C21 H28 N4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCOCCCNC(C(CCC1)CN1c1nccnc1Sc1ccccc1)=O

InChI

InChI=1S/C21H28N4O2S/c1-2-27-15-7-11-23-20(26)17-8-6-14-25(16-17)19-21(24-13-12-22-19)28-18-9-4-3-5-10-18/h3-5,9-10,12-13,17H,2,6-8,11,14-16H2,1H3,(H,23,26)/t17-/m0/s1

InChI Key

IYFKRIOTYVKCAF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD15136659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.960

Distribution Coefficient, logD

2.960

Water Solubility, LogSw

-3.14

Polar Surface Area

54.017

Acid Dissociation Constant (pKa)

14.87

Base Dissociation Constant (pKb)

5.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.60

L895-0310 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 L895-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L895-0310?
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What is the minimum amount of L895-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L895-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L895-0310
  • 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 L895-0310 available by request