P799-0433 Screening compound: 2-(2,5-difluorobenzyl)-4-(3-fluorophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione

P799-0433 Screening compound: 2-(2,5-difluorobenzyl)-4-(3-fluorophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
P799-0433 Screening compound: 2-(2,5-difluorobenzyl)-4-(3-fluorophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound P799-0433
2-(2,5-difluorobenzyl)-4-(3-fluorophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione

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

P799-0433

Molecular Formula

C19H12F3N3O3S (C19 H12 F3 N3 O3 S)

Compound Name

2-(2,5-difluorobenzyl)-4-(3-fluorophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione

IUPAC name

2-[(25-difluorophenyl)methyl]-4-(3-fluorophenyl)-2H3H4H-1lambda6-pyrido[23-e][124]thiadiazine-113-trione

SMILES

O=C(N1Cc(cc(cc2)F)c2F)N(c2cc(F)ccc2)c(nccc2)c2S1(=O)=O

InChI

InChI=1S/C19H12F3N3O3S/c20-13-3-1-4-15(10-13)25-18-17(5-2-8-23-18)29(27,28)24(19(25)26)11-12-9-14(21)6-7-16(12)22/h1-10H,11H2

InChI Key

GAVZZPHBTBJDJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27615075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.433

Distribution Coefficient, logD

3.433

Water Solubility, LogSw

-3.67

Polar Surface Area

56.679

Acid Dissociation Constant (pKa)

25.79

Base Dissociation Constant (pKb)

-3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

P799-0433 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 P799-0433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P799-0433?
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What is the minimum amount of P799-0433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P799-0433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P799-0433
  • 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 P799-0433 available by request