L898-1211 Screening compound: N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)acetamide

L898-1211 Screening compound: N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)acetamide
L898-1211 Screening compound: N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L898-1211
N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]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

L898-1211

Molecular Formula

C20H18FN3O2S2 (C20 H18 FN3 O2 S2)

Compound Name

N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)acetamide

IUPAC name

N-(3-fluoro-4-methoxyphenyl)-2-({3-[(3-methylphenyl)sulfanyl]pyrazin-2-yl}sulfanyl)acetamide

SMILES

Cc1cccc(Sc2nccnc2SCC(Nc(cc2)cc(F)c2OC)=O)c1

InChI

InChI=1S/C20H18FN3O2S2/c1-13-4-3-5-15(10-13)28-20-19(22-8-9-23-20)27-12-18(25)24-14-6-7-17(26-2)16(21)11-14/h3-11H,12H2,1-2H3,(H,24,25)

InChI Key

MNIAJOJLOBIIKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27485199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.505

Distribution Coefficient, logD

4.505

Water Solubility, LogSw

-4.39

Polar Surface Area

48.834

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

L898-1211 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L898-1211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L898-1211?
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What is the minimum amount of L898-1211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L898-1211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L898-1211
  • 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 L898-1211 available by request