8008-7292 Screening compound: 6-[(4-nitrobenzyl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione

8008-7292 Screening compound: 6-[(4-nitrobenzyl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione
8008-7292 Screening compound: 6-[(4-nitrobenzyl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-7292
6-[(4-nitrobenzyl)sulfanyl]-1,2,4-triazine-3,5(2H,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

8008-7292

Molecular Formula

C10H8N4O4S (C10 H8 N4 O4 S)

Compound Name

6-[(4-nitrobenzyl)sulfanyl]-1,2,4-triazine-3,5(2H,4H)-dione

IUPAC name

6-{[(4-nitrophenyl)methyl]sulfanyl}-2345-tetrahydro-124-triazine-35-dione

SMILES

[O-][N+](c1ccc(CSC(C(N2)=O)=NNC2=O)cc1)=O

InChI

InChI=1S/C10H8N4O4S/c15-8-9(12-13-10(16)11-8)19-5-6-1-3-7(4-2-6)14(17)18/h1-4H,5H2,(H2,11,13,15,16)

InChI Key

IATOGVGBVDKIIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01150916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.26

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.753

Distribution Coefficient, logD

0.733

Water Solubility, LogSw

-2.37

Polar Surface Area

94.436

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

-1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8008-7292 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8008-7292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-7292?
Check Price and Availability of 8008-7292, 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 8008-7292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-7292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-7292
  • 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 8008-7292 available by request