D423-0126 Screening compound: 3-(2-butoxyphenyl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

D423-0126 Screening compound: 3-(2-butoxyphenyl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
D423-0126 Screening compound: 3-(2-butoxyphenyl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D423-0126
3-(2-butoxyphenyl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

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

D423-0126

Molecular Formula

C20H20N4OS (C20 H20 N4 OS)

Compound Name

3-(2-butoxyphenyl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

IUPAC name

3-(2-butoxyphenyl)-6-phenyl-7H-[124]triazolo[34-b][134]thiadiazine

SMILES

CCCCOc(cccc1)c1-c1nnc2SCC(c3ccccc3)=Nn12

InChI

InChI=1S/C20H20N4OS/c1-2-3-13-25-18-12-8-7-11-16(18)19-21-22-20-24(19)23-17(14-26-20)15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3

InChI Key

CYEUNWCXLIWOEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.092

Distribution Coefficient, logD

5.085

Water Solubility, LogSw

-4.95

Polar Surface Area

41.463

Acid Dissociation Constant (pKa)

19.46

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D423-0126 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D423-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D423-0126?
Check Price and Availability of D423-0126, 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 D423-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D423-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D423-0126
  • 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 D423-0126 available by request