L863-2078 Screening compound: N-(2,4-difluorophenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

L863-2078 Screening compound: N-(2,4-difluorophenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide
L863-2078 Screening compound: N-(2,4-difluorophenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L863-2078
N-(2,4-difluorophenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]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

L863-2078

Molecular Formula

C21H16F2N4O3S2 (C21 H16 F2 N4 O3 S2)

Compound Name

N-(2,4-difluorophenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

IUPAC name

N-(24-difluorophenyl)-2-[2-(ethylsulfanyl)-57-dioxo-6-phenyl-4H5H6H7H-[13]thiazolo[45-d]pyrimidin-4-yl]acetamide

SMILES

CCSc1nc(N(CC(Nc(ccc(F)c2)c2F)=O)C(N(c2ccccc2)C2=O)=O)c2s1

InChI

InChI=1S/C21H16F2N4O3S2/c1-2-31-20-25-18-17(32-20)19(29)27(13-6-4-3-5-7-13)21(30)26(18)11-16(28)24-15-9-8-12(22)10-14(15)23/h3-10H,2,11H2,1H3,(H,24,28)

InChI Key

VRIPZOLBTPZQRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.191

Distribution Coefficient, logD

4.185

Water Solubility, LogSw

-4.09

Polar Surface Area

63.756

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

-0.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

L863-2078 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L863-2078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L863-2078?
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What is the minimum amount of L863-2078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L863-2078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L863-2078
  • 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 L863-2078 available by request