7238-1656 Screening compound: N-benzyl-6-(4-fluorophenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

7238-1656 Screening compound: N-benzyl-6-(4-fluorophenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
7238-1656 Screening compound: N-benzyl-6-(4-fluorophenyl)-3-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 7238-1656
N-benzyl-6-(4-fluorophenyl)-3-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

7238-1656

Molecular Formula

C24H20FN5OS (C24 H20 FN5 OS)

Compound Name

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

IUPAC name

N-benzyl-6-(4-fluorophenyl)-3-phenyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carboxamide

SMILES

O=C(C1Sc2nnc(-c3ccccc3)n2NC1c(cc1)ccc1F)NCc1ccccc1

InChI

InChI=1S/C24H20FN5OS/c25-19-13-11-17(12-14-19)20-21(23(31)26-15-16-7-3-1-4-8-16)32-24-28-27-22(30(24)29-20)18-9-5-2-6-10-18/h1-14,20-21,29H,15H2,(H,26,31)

InChI Key

GHPMIPYSZUKYDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08098676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.079

Distribution Coefficient, logD

4.079

Water Solubility, LogSw

-4.27

Polar Surface Area

61.105

Acid Dissociation Constant (pKa)

12.16

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

12.50

7238-1656 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 7238-1656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7238-1656?
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What is the minimum amount of 7238-1656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7238-1656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7238-1656
  • 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 7238-1656 available by request