L863-2077 Screening compound: N-(2,6-dimethylphenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

L863-2077 Screening compound: N-(2,6-dimethylphenyl)-2-[2-(ethylsulfanyl)-5,7-dioxo-6-phenyl-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide
L863-2077 Screening compound: N-(2,6-dimethylphenyl)-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 L863-2077
N-(2,6-dimethylphenyl)-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

L863-2077

Molecular Formula

C23H22N4O3S2 (C23 H22 N4 O3 S2)

Compound Name

N-(2,6-dimethylphenyl)-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-(26-dimethylphenyl)-2-[2-(ethylsulfanyl)-57-dioxo-6-phenyl-4H5H6H7H-[13]thiazolo[45-d]pyrimidin-4-yl]acetamide

SMILES

CCSc1nc(N(CC(Nc2c(C)cccc2C)=O)C(N(c2ccccc2)C2=O)=O)c2s1

InChI

InChI=1S/C23H22N4O3S2/c1-4-31-22-25-20-19(32-22)21(29)27(16-11-6-5-7-12-16)23(30)26(20)13-17(28)24-18-14(2)9-8-10-15(18)3/h5-12H,4,13H2,1-3H3,(H,24,28)

InChI Key

XORXRQZXZHSNSV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.58

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

4.460

Distribution Coefficient, logD

4.460

Water Solubility, LogSw

-4.23

Polar Surface Area

63.059

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

-0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

L863-2077 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L863-2077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L863-2077?
Check Price and Availability of L863-2077, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L863-2077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L863-2077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L863-2077
  • 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 L863-2077 available by request