7238-2052 Screening compound: 4-[6-(4-methylphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl]morpholine

7238-2052 Screening compound: 4-[6-(4-methylphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl]morpholine
7238-2052 Screening compound: 4-[6-(4-methylphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7238-2052
4-[6-(4-methylphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl]morpholine

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

7238-2052

Molecular Formula

C22H23N5O2S (C22 H23 N5 O2 S)

Compound Name

4-[6-(4-methylphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl]morpholine

IUPAC name

4-[6-(4-methylphenyl)-3-phenyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carbonyl]morpholine

SMILES

Cc1ccc(C(C(C(N2CCOCC2)=O)S2)Nn3c2nnc3-c2ccccc2)cc1

InChI

InChI=1S/C22H23N5O2S/c1-15-7-9-16(10-8-15)18-19(21(28)26-11-13-29-14-12-26)30-22-24-23-20(27(22)25-18)17-5-3-2-4-6-17/h2-10,18-19,25H,11-14H2,1H3

InChI Key

LFJLHHYOJUDRJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712497

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.144

Distribution Coefficient, logD

3.144

Water Solubility, LogSw

-3.14

Polar Surface Area

61.249

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

31.80

7238-2052 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7238-2052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7238-2052?
Check Price and Availability of 7238-2052, 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 7238-2052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7238-2052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7238-2052
  • 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 7238-2052 available by request