0781-2860A Screening compound: ({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate

0781-2860A Screening compound: ({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate
0781-2860A Screening compound: ({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0781-2860A
({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate

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

0781-2860A

Molecular Formula

C8H14N6O10 (C8 H14 N6 O10)

Compound Name

({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate

IUPAC name

({[({[(acetyloxy)methyl](nitro)amino}methyl)(nitro)amino]methyl}(nitro)amino)methyl acetate

SMILES

CC(OCN(CN(CN(COC(C)=O)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)=O

InChI

InChI=1S/C8H14N6O10/c1-7(15)23-5-10(13(19)20)3-9(12(17)18)4-11(14(21)22)6-24-8(2)16/h3-6H2,1-2H3

InChI Key

CHBKPOAEXQUKHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00388314

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.23

Hydrogen Bond Acceptors Count

18.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

16

Partition Coefficient, logP

0.720

Distribution Coefficient, logD

0.720

Water Solubility, LogSw

-0.39

Polar Surface Area

182.446

Acid Dissociation Constant (pKa)

16.11

Base Dissociation Constant (pKb)

-9.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

75.00

References: we are preparing a list of scientific research reports with 0781-2860A chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0781-2860A?
Check Price and Availability of 0781-2860A, 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 0781-2860A you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0781-2860A
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0781-2860A
  • 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 0781-2860A available by request