L981-0653 Screening compound: N-(2,5-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide

L981-0653 Screening compound: N-(2,5-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide
L981-0653 Screening compound: N-(2,5-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L981-0653
N-(2,5-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide

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

L981-0653

Molecular Formula

C26H31N5O3S (C26 H31 N5 O3 S)

Compound Name

N-(2,5-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide

IUPAC name

N-(25-diethoxyphenyl)-2-{[3-(4-phenylpiperazin-1-yl)pyrazin-2-yl]sulfanyl}acetamide

SMILES

CCOc(cc1)cc(NC(CSc2nccnc2N(CC2)CCN2c2ccccc2)=O)c1OCC

InChI

InChI=1S/C26H31N5O3S/c1-3-33-21-10-11-23(34-4-2)22(18-21)29-24(32)19-35-26-25(27-12-13-28-26)31-16-14-30(15-17-31)20-8-6-5-7-9-20/h5-13,18H,3-4,14-17,19H2,1-2H3,(H,29,32)

InChI Key

PMZLBWMOWRWSJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16635932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.469

Distribution Coefficient, logD

4.469

Water Solubility, LogSw

-4.21

Polar Surface Area

61.625

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

L981-0653 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L981-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L981-0653?
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What is the minimum amount of L981-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L981-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L981-0653
  • 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 L981-0653 available by request