D727-0300 Screening compound: 7-(3,4-dimethoxyphenyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

D727-0300 Screening compound: 7-(3,4-dimethoxyphenyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
D727-0300 Screening compound: 7-(3,4-dimethoxyphenyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D727-0300
7-(3,4-dimethoxyphenyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

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

D727-0300

Molecular Formula

C13H12N4O3S (C13 H12 N4 O3 S)

Compound Name

7-(3,4-dimethoxyphenyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

IUPAC name

7-(34-dimethoxyphenyl)-3-methyl-4H-[134]thiadiazolo[23-c][124]triazin-4-one

SMILES

CC1=NN=C2SC(c(cc3)cc(OC)c3OC)=NN2C1=O

InChI

InChI=1S/C13H12N4O3S/c1-7-12(18)17-13(15-14-7)21-11(16-17)8-4-5-9(19-2)10(6-8)20-3/h4-6H,1-3H3

InChI Key

PWBXKBASYWRTKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08684166

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.767

Distribution Coefficient, logD

1.716

Water Solubility, LogSw

-2.40

Polar Surface Area

62.531

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

6.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

D727-0300 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D727-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D727-0300?
Check Price and Availability of D727-0300, 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 D727-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D727-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D727-0300
  • 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 D727-0300 available by request