6294-0006 Screening compound: diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate

6294-0006 Screening compound: diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate
6294-0006 Screening compound: diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6294-0006
diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate

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

6294-0006

Molecular Formula

C16H21N2O3P (C16 H21 N2 O3 P)

Compound Name

diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate

IUPAC name

diethyl {phenyl[(pyridin-2-yl)amino]methyl}phosphonate

SMILES

CCOP(C(c1ccccc1)Nc1ncccc1)(OCC)=O

InChI

InChI=1S/C16H21N2O3P/c1-3-20-22(19,21-4-2)16(14-10-6-5-7-11-14)18-15-12-8-9-13-17-15/h5-13,16H,3-4H2,1-2H3,(H,17,18)/t16-/m0/s1

InChI Key

IHUDGZQJDWGSIJ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD00810300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.037

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-3.14

Polar Surface Area

49.730

Acid Dissociation Constant (pKa)

16.73

Base Dissociation Constant (pKb)

4.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

6294-0006 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6294-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6294-0006?
Check Price and Availability of 6294-0006, 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 6294-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6294-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6294-0006
  • 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 6294-0006 available by request