5461-0142 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide

5461-0142 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide
5461-0142 Screening compound: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5461-0142
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide

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

5461-0142

Molecular Formula

C11H12N4OS2 (C11 H12 N4 OS2)

Compound Name

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide

IUPAC name

2-[(5-amino-134-thiadiazol-2-yl)sulfanyl]-N-benzylacetamide

SMILES

Nc1nnc(SCC(NCc2ccccc2)=O)s1

InChI

InChI=1S/C11H12N4OS2/c12-10-14-15-11(18-10)17-7-9(16)13-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,12,14)(H,13,16)

InChI Key

XSEHXURFQKRVRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00442893

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.277

Distribution Coefficient, logD

1.277

Water Solubility, LogSw

-1.95

Polar Surface Area

68.101

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

References: we are preparing a list of scientific research reports with 5461-0142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5461-0142?
Check Price and Availability of 5461-0142, 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 5461-0142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5461-0142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5461-0142
  • 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 5461-0142 available by request