L981-0538 Screening compound: 2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide

L981-0538 Screening compound: 2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide
L981-0538 Screening compound: 2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L981-0538
2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)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

L981-0538

Molecular Formula

C25H29N5OS (C25 H29 N5 OS)

Compound Name

2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide

IUPAC name

2-({3-[4-(23-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide

SMILES

Cc1cccc(N(CC2)CCN2c2nccnc2SCC(Nc2c(C)cccc2)=O)c1C

InChI

InChI=1S/C25H29N5OS/c1-18-8-6-10-22(20(18)3)29-13-15-30(16-14-29)24-25(27-12-11-26-24)32-17-23(31)28-21-9-5-4-7-19(21)2/h4-12H,13-17H2,1-3H3,(H,28,31)

InChI Key

MPHPFBBNSQSBJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15137870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.896

Distribution Coefficient, logD

4.895

Water Solubility, LogSw

-4.43

Polar Surface Area

46.990

Acid Dissociation Constant (pKa)

12.48

Base Dissociation Constant (pKb)

5.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with L981-0538 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L981-0538?
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What is the minimum amount of L981-0538 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L981-0538
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L981-0538
  • 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 L981-0538 available by request