T744-0137 Screening compound: 2-(4-fluorophenoxy)ethyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate

T744-0137 Screening compound: 2-(4-fluorophenoxy)ethyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
T744-0137 Screening compound: 2-(4-fluorophenoxy)ethyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound T744-0137
2-(4-fluorophenoxy)ethyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate

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

T744-0137

Molecular Formula

C14H15FN2O5S (C14 H15 FN2 O5 S)

Compound Name

2-(4-fluorophenoxy)ethyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate

IUPAC name

2-(4-fluorophenoxy)ethyl 25-dimethyl-11-dioxo-2H-1lambda626-thiadiazine-4-carboxylate

SMILES

CC(C(C(OCCOc(cc1)ccc1F)=O)=CN1C)=NS1(=O)=O

InChI

InChI=1S/C14H15FN2O5S/c1-10-13(9-17(2)23(19,20)16-10)14(18)22-8-7-21-12-5-3-11(15)4-6-12/h3-6,9H,7-8H2,1-2H3

InChI Key

CJQNVSBXIMICOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.005

Distribution Coefficient, logD

1.005

Water Solubility, LogSw

-2.21

Polar Surface Area

71.919

Acid Dissociation Constant (pKa)

26.42

Base Dissociation Constant (pKb)

-3.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

T744-0137 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Anti-HIV1 Library (19540 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with T744-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T744-0137?
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What is the minimum amount of T744-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T744-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T744-0137
  • 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 T744-0137 available by request