L784-0058 Screening compound: 2-(4-methylphenyl)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide

L784-0058 Screening compound: 2-(4-methylphenyl)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
L784-0058 Screening compound: 2-(4-methylphenyl)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L784-0058
2-(4-methylphenyl)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-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

L784-0058

Molecular Formula

C20H17N5O2S2 (C20 H17 N5 O2 S2)

Compound Name

2-(4-methylphenyl)-N-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide

IUPAC name

2-(4-methylphenyl)-N-(5-{[(3-oxo-34-dihydroquinoxalin-2-yl)methyl]sulfanyl}-134-thiadiazol-2-yl)acetamide

SMILES

Cc1ccc(CC(Nc2nnc(SCC3=Nc(cccc4)c4NC3=O)s2)=O)cc1

InChI

InChI=1S/C20H17N5O2S2/c1-12-6-8-13(9-7-12)10-17(26)23-19-24-25-20(29-19)28-11-16-18(27)22-15-5-3-2-4-14(15)21-16/h2-9H,10-11H2,1H3,(H,22,27)(H,23,24,26)

InChI Key

JWKUPUGLPATYIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15134798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.744

Distribution Coefficient, logD

3.737

Water Solubility, LogSw

-3.98

Polar Surface Area

78.640

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with L784-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L784-0058?
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What is the minimum amount of L784-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L784-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L784-0058
  • 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 L784-0058 available by request