L863-2101 Screening compound: N-(3-acetylphenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

L863-2101 Screening compound: N-(3-acetylphenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide
L863-2101 Screening compound: N-(3-acetylphenyl)-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 L863-2101
N-(3-acetylphenyl)-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

L863-2101

Molecular Formula

C23H20N4O4S2 (C23 H20 N4 O4 S2)

Compound Name

N-(3-acetylphenyl)-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-(3-acetylphenyl)-2-[2-(ethylsulfanyl)-57-dioxo-6-phenyl-4H5H6H7H-[13]thiazolo[45-d]pyrimidin-4-yl]acetamide

SMILES

CCSc1nc(N(CC(Nc2cc(C(C)=O)ccc2)=O)C(N(c2ccccc2)C2=O)=O)c2s1

InChI

InChI=1S/C23H20N4O4S2/c1-3-32-22-25-20-19(33-22)21(30)27(17-10-5-4-6-11-17)23(31)26(20)13-18(29)24-16-9-7-8-15(12-16)14(2)28/h4-12H,3,13H2,1-2H3,(H,24,29)

InChI Key

WZZBJYRHWOIIAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.016

Distribution Coefficient, logD

4.016

Water Solubility, LogSw

-3.99

Polar Surface Area

78.281

Acid Dissociation Constant (pKa)

11.27

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with L863-2101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L863-2101?
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What is the minimum amount of L863-2101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L863-2101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L863-2101
  • 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 L863-2101 available by request