0469-0718 Screening compound: dipropyl {[(2-cyanoethyl)(propyl)amino]methyl}phosphonate

0469-0718 Screening compound: dipropyl {[(2-cyanoethyl)(propyl)amino]methyl}phosphonate
0469-0718 Screening compound: dipropyl {[(2-cyanoethyl)(propyl)amino]methyl}phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0469-0718
dipropyl {[(2-cyanoethyl)(propyl)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

0469-0718

Molecular Formula

C13H27N2O3P (C13 H27 N2 O3 P)

Compound Name

dipropyl {[(2-cyanoethyl)(propyl)amino]methyl}phosphonate

IUPAC name

dipropyl {[(2-cyanoethyl)(propyl)amino]methyl}phosphonate

SMILES

CCCN(CCC#N)CP(OCCC)(OCCC)=O

InChI

InChI=1S/C13H27N2O3P/c1-4-9-15(10-7-8-14)13-19(16,17-11-5-2)18-12-6-3/h4-7,9-13H2,1-3H3

InChI Key

YVNCIODDXPYAEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01930188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.509

Distribution Coefficient, logD

1.509

Water Solubility, LogSw

-1.11

Polar Surface Area

49.971

Acid Dissociation Constant (pKa)

21.71

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

92.30

References: we are preparing a list of scientific research reports with 0469-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0469-0718?
Check Price and Availability of 0469-0718, 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 0469-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0469-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0469-0718
  • 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 0469-0718 available by request