0096-0139 Screening compound: 1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine

0096-0139 Screening compound: 1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine
0096-0139 Screening compound: 1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0096-0139
1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine

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

0096-0139

Molecular Formula

C6H12N8 (C6 H12 N8)

Compound Name

1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine

IUPAC name

1-(2-{3-methyl-2-[2-(1H-triazirin-1-yl)ethyl]diaziridin-1-yl}ethyl)-1H-triazirine

SMILES

CC1N(CCN2N=N2)N1CCN1N=N1

InChI

InChI=1S/C6H12N8/c1-6-11(2-4-13-7-8-13)12(6)3-5-14-9-10-14/h6H,2-5H2,1H3

InChI Key

WJAGVACZUCRBEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00483615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

196.22

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.291

Distribution Coefficient, logD

-0.291

Water Solubility, LogSw

0.62

Polar Surface Area

60.199

Acid Dissociation Constant (pKa)

20.97

Base Dissociation Constant (pKb)

3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

100.00

References: we are preparing a list of scientific research reports with 0096-0139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0096-0139?
Check Price and Availability of 0096-0139, 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 0096-0139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0096-0139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0096-0139
  • 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 0096-0139 available by request