D038-1262 Screening compound: 2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide

D038-1262 Screening compound: 2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
D038-1262 Screening compound: 2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D038-1262
2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-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

D038-1262

Molecular Formula

C14H13N3O2S2 (C14 H13 N3 O2 S2)

Compound Name

2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

2-(6-methyl-1-benzofuran-3-yl)-N-[5-(methylsulfanyl)-134-thiadiazol-2-yl]acetamide

SMILES

Cc(cc1)cc2c1c(CC(Nc1nnc(SC)s1)=O)co2

InChI

InChI=1S/C14H13N3O2S2/c1-8-3-4-10-9(7-19-11(10)5-8)6-12(18)15-13-16-17-14(20-2)21-13/h3-5,7H,6H2,1-2H3,(H,15,16,18)

InChI Key

WISLCFAFPDOQLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06649039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.839

Distribution Coefficient, logD

3.831

Water Solubility, LogSw

-3.94

Polar Surface Area

55.582

Acid Dissociation Constant (pKa)

9.10

Base Dissociation Constant (pKb)

-3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

D038-1262 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D038-1262 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D038-1262?
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What is the minimum amount of D038-1262 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D038-1262
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D038-1262
  • 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 D038-1262 available by request