1225-0468 Screening compound: 2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-3,4-diol

1225-0468 Screening compound: 2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-3,4-diol
1225-0468 Screening compound: 2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-3,4-diol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1225-0468
2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-3,4-diol

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

1225-0468

Molecular Formula

C11H14N2O6 (C11 H14 N2 O6)

Compound Name

2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-3,4-diol

IUPAC name

2-(hydroxymethyl)-5-[(4-nitrophenyl)amino]oxolane-34-diol

SMILES

[O-][N+](c(cc1)ccc1NC(C1O)OC(CO)C1O)=O

InChI

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

InChI Key

QJZGERHAPGWLSY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01162564

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

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.466

Distribution Coefficient, logD

0.466

Water Solubility, LogSw

-1.85

Polar Surface Area

101.159

Acid Dissociation Constant (pKa)

13.39

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

45.50

1225-0468 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 1225-0468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1225-0468?
Check Price and Availability of 1225-0468, 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 1225-0468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1225-0468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1225-0468
  • 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 1225-0468 available by request