D137-0223 Screening compound: N-(2,5-dimethylphenyl)-3-ethyl-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

D137-0223 Screening compound: N-(2,5-dimethylphenyl)-3-ethyl-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
D137-0223 Screening compound: N-(2,5-dimethylphenyl)-3-ethyl-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D137-0223
N-(2,5-dimethylphenyl)-3-ethyl-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-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

D137-0223

Molecular Formula

C21H23N5OS (C21 H23 N5 OS)

Compound Name

N-(2,5-dimethylphenyl)-3-ethyl-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

IUPAC name

N-(25-dimethylphenyl)-3-ethyl-6-phenyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carboxamide

SMILES

CCc(n1NC2c3ccccc3)nnc1SC2C(Nc1c(C)ccc(C)c1)=O

InChI

InChI=1S/C21H23N5OS/c1-4-17-23-24-21-26(17)25-18(15-8-6-5-7-9-15)19(28-21)20(27)22-16-12-13(2)10-11-14(16)3/h5-12,18-19,25H,4H2,1-3H3,(H,22,27)

InChI Key

WJRYYLHDJNRAKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08107003

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.575

Distribution Coefficient, logD

3.575

Water Solubility, LogSw

-3.61

Polar Surface Area

60.333

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

1.82

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.60

D137-0223 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D137-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D137-0223?
Check Price and Availability of D137-0223, 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 D137-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D137-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D137-0223
  • 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 D137-0223 available by request