L863-0214 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-5,7-dioxo-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

L863-0214 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-5,7-dioxo-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide
L863-0214 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-5,7-dioxo-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L863-0214
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-5,7-dioxo-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

L863-0214

Molecular Formula

C23H20N4O5S2 (C23 H20 N4 O5 S2)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-5,7-dioxo-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-[6-(4-methylphenyl)-2-(methylsulfanyl)-57-dioxo-4H5H6H7H-[13]thiazolo[45-d]pyrimidin-4-yl]acetamide

SMILES

Cc(cc1)ccc1N(C(c1c(N2CC(NCc(cc3)cc4c3OCO4)=O)nc(SC)s1)=O)C2=O

InChI

InChI=1S/C23H20N4O5S2/c1-13-3-6-15(7-4-13)27-21(29)19-20(25-22(33-2)34-19)26(23(27)30)11-18(28)24-10-14-5-8-16-17(9-14)32-12-31-16/h3-9H,10-12H2,1-2H3,(H,24,28)

InChI Key

RWKKSCOAANUSML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482157

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.876

Distribution Coefficient, logD

3.876

Water Solubility, LogSw

-3.89

Polar Surface Area

82.892

Acid Dissociation Constant (pKa)

14.98

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with L863-0214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L863-0214?
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What is the minimum amount of L863-0214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L863-0214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L863-0214
  • 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 L863-0214 available by request