8004-6720 Screening compound: 2-[(2-nitrophenyl)amino]oxane-3,4,5-triol

8004-6720 Screening compound: 2-[(2-nitrophenyl)amino]oxane-3,4,5-triol
8004-6720 Screening compound: 2-[(2-nitrophenyl)amino]oxane-3,4,5-triol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-6720
2-[(2-nitrophenyl)amino]oxane-3,4,5-triol

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

8004-6720

Molecular Formula

C11H14N2O6 (C11 H14 N2 O6)

Compound Name

2-[(2-nitrophenyl)amino]oxane-3,4,5-triol

IUPAC name

2-[(2-nitrophenyl)amino]oxane-345-triol

SMILES

[O-][N+](c(cccc1)c1NC(C(C1O)O)OCC1O)=O

InChI

InChI=1S/C11H14N2O6/c14-8-5-19-11(10(16)9(8)15)12-6-3-1-2-4-7(6)13(17)18/h1-4,8-12,14-16H,5H2

InChI Key

KGPWBFBBGLVSFD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.24

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.052

Distribution Coefficient, logD

-0.052

Water Solubility, LogSw

-1.75

Polar Surface Area

98.819

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with 8004-6720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-6720?
Check Price and Availability of 8004-6720, 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 8004-6720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-6720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-6720
  • 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 8004-6720 available by request