L981-0622 Screening compound: methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate

L981-0622 Screening compound: methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate
L981-0622 Screening compound: methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L981-0622
methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate

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

L981-0622

Molecular Formula

C24H27N5O3S2 (C24 H27 N5 O3 S2)

Compound Name

methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate

IUPAC name

methyl 3-[2-({3-[4-(23-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate

SMILES

Cc1cccc(N(CC2)CCN2c2nccnc2SCC(Nc2c(C(OC)=O)scc2)=O)c1C

InChI

InChI=1S/C24H27N5O3S2/c1-16-5-4-6-19(17(16)2)28-10-12-29(13-11-28)22-23(26-9-8-25-22)34-15-20(30)27-18-7-14-33-21(18)24(31)32-3/h4-9,14H,10-13,15H2,1-3H3,(H,27,30)

InChI Key

MJYAZVLCCDIFSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16635931

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.519

Distribution Coefficient, logD

4.484

Water Solubility, LogSw

-4.19

Polar Surface Area

69.183

Acid Dissociation Constant (pKa)

8.48

Base Dissociation Constant (pKb)

5.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L981-0622 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 L981-0622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L981-0622?
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What is the minimum amount of L981-0622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L981-0622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L981-0622
  • 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 L981-0622 available by request