D725-0048 Screening compound: N-(2-methyl-4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide

D725-0048 Screening compound: N-(2-methyl-4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide
D725-0048 Screening compound: N-(2-methyl-4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D725-0048
N-(2-methyl-4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide

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

D725-0048

Molecular Formula

C16H13N5OS2 (C16 H13 N5 OS2)

Compound Name

N-(2-methyl-4-{3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide

IUPAC name

N-(2-methyl-4-{3-methyl-[124]triazolo[34-b][134]thiadiazol-6-yl}phenyl)thiophene-2-carboxamide

SMILES

Cc1nnc2sc(-c(cc3)cc(C)c3NC(c3cccs3)=O)nn12

InChI

InChI=1S/C16H13N5OS2/c1-9-8-11(15-20-21-10(2)18-19-16(21)24-15)5-6-12(9)17-14(22)13-4-3-7-23-13/h3-8H,1-2H3,(H,17,22)

InChI Key

CVZUAQUIAQZGEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05238785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.593

Distribution Coefficient, logD

2.593

Water Solubility, LogSw

-3.02

Polar Surface Area

58.182

Acid Dissociation Constant (pKa)

12.30

Base Dissociation Constant (pKb)

0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with D725-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D725-0048?
Check Price and Availability of D725-0048, 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 D725-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D725-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D725-0048
  • 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 D725-0048 available by request