4167-0284 Screening compound: 4,6-dinitro-5,7-bis(piperidin-1-yl)-2,1,3-benzothiadiazole

4167-0284 Screening compound: 4,6-dinitro-5,7-bis(piperidin-1-yl)-2,1,3-benzothiadiazole
4167-0284 Screening compound: 4,6-dinitro-5,7-bis(piperidin-1-yl)-2,1,3-benzothiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4167-0284
4,6-dinitro-5,7-bis(piperidin-1-yl)-2,1,3-benzothiadiazole

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

4167-0284

Molecular Formula

C16H20N6O4S (C16 H20 N6 O4 S)

Compound Name

4,6-dinitro-5,7-bis(piperidin-1-yl)-2,1,3-benzothiadiazole

IUPAC name

46-dinitro-57-bis(piperidin-1-yl)-213-benzothiadiazole

SMILES

[O-][N+](c(c1nsnc1c(N1CCCCC1)c1[N+]([O-])=O)c1N1CCCCC1)=O

InChI

InChI=1S/C16H20N6O4S/c23-21(24)14-12-11(17-27-18-12)13(19-7-3-1-4-8-19)16(22(25)26)15(14)20-9-5-2-6-10-20/h1-10H2

InChI Key

SRJZUYGKMDCXTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03014014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.138

Distribution Coefficient, logD

4.138

Water Solubility, LogSw

-4.23

Polar Surface Area

93.222

Acid Dissociation Constant (pKa)

26.57

Base Dissociation Constant (pKb)

-2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

References: we are preparing a list of scientific research reports with 4167-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4167-0284?
Check Price and Availability of 4167-0284, 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 4167-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4167-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4167-0284
  • 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 4167-0284 available by request