7238-1541 Screening compound: 1-{3,6-diphenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl}pyrrolidine

7238-1541 Screening compound: 1-{3,6-diphenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl}pyrrolidine
7238-1541 Screening compound: 1-{3,6-diphenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl}pyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7238-1541
1-{3,6-diphenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl}pyrrolidine

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

7238-1541

Molecular Formula

C21H21N5OS (C21 H21 N5 OS)

Compound Name

1-{3,6-diphenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carbonyl}pyrrolidine

IUPAC name

1-{36-diphenyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carbonyl}pyrrolidine

SMILES

O=C(C1Sc2nnc(-c3ccccc3)n2NC1c1ccccc1)N1CCCC1

InChI

InChI=1S/C21H21N5OS/c27-20(25-13-7-8-14-25)18-17(15-9-3-1-4-10-15)24-26-19(22-23-21(26)28-18)16-11-5-2-6-12-16/h1-6,9-12,17-18,24H,7-8,13-14H2

InChI Key

YDMXUBUKLKHBKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712462

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.5

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

3.669

Distribution Coefficient, logD

3.669

Water Solubility, LogSw

-3.89

Polar Surface Area

53.706

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.60

7238-1541 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7238-1541 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7238-1541?
Check Price and Availability of 7238-1541, 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 7238-1541 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7238-1541
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7238-1541
  • 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 7238-1541 available by request