0527-0242 Screening compound: 2-[(3-nitrophenyl)amino]oxane-3,4,5-triol

0527-0242 Screening compound: 2-[(3-nitrophenyl)amino]oxane-3,4,5-triol
0527-0242 Screening compound: 2-[(3-nitrophenyl)amino]oxane-3,4,5-triol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0527-0242
2-[(3-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

0527-0242

Molecular Formula

C11H14N2O6 (C11 H14 N2 O6)

Compound Name

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

IUPAC name

2-[(3-nitrophenyl)amino]oxane-345-triol

SMILES

[O-][N+](c1cc(NC(C(C2O)O)OCC2O)ccc1)=O

InChI

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

InChI Key

LZYBXOWFOCKWJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00555493

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

0.000

Distribution Coefficient, logD

0.000

Water Solubility, LogSw

-1.91

Polar Surface Area

99.818

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

1.73

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with 0527-0242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0527-0242?
Check Price and Availability of 0527-0242, 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 0527-0242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0527-0242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0527-0242
  • 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 0527-0242 available by request