P798-0114 Screening compound: 4-(4-bromophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1(4H)-dione

P798-0114 Screening compound: 4-(4-bromophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1(4H)-dione
P798-0114 Screening compound: 4-(4-bromophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1(4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound P798-0114
4-(4-bromophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1(4H)-dione

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

P798-0114

Molecular Formula

C12H8BrN3O2S (C12 H8 BrN3 O2 S)

Compound Name

4-(4-bromophenyl)-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1(4H)-dione

IUPAC name

4-(4-bromophenyl)-4H-1lambda6-pyrido[23-e][124]thiadiazine-11-dione

SMILES

O=S1(N=CN(c(cc2)ccc2Br)c2ncccc12)=O

InChI

InChI=1S/C12H8BrN3O2S/c13-9-3-5-10(6-4-9)16-8-15-19(17,18)11-2-1-7-14-12(11)16/h1-8H

InChI Key

UJIMSBZTARMVPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27615007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.18

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.352

Distribution Coefficient, logD

2.352

Water Solubility, LogSw

-2.50

Polar Surface Area

53.350

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

3.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

P798-0114 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P798-0114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P798-0114?
Check Price and Availability of P798-0114, 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 P798-0114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P798-0114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P798-0114
  • 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 P798-0114 available by request