8012-8101 Screening compound: diisopropyl [2-(diphenylamino)-2-oxoethyl]phosphonate

8012-8101 Screening compound: diisopropyl [2-(diphenylamino)-2-oxoethyl]phosphonate
8012-8101 Screening compound: diisopropyl [2-(diphenylamino)-2-oxoethyl]phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-8101
diisopropyl [2-(diphenylamino)-2-oxoethyl]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

8012-8101

Molecular Formula

C20H26NO4P (C20 H26 NO4 P)

Compound Name

diisopropyl [2-(diphenylamino)-2-oxoethyl]phosphonate

IUPAC name

bis(propan-2-yl) [(diphenylcarbamoyl)methyl]phosphonate

SMILES

CC(C)OP(CC(N(c1ccccc1)c1ccccc1)=O)(OC(C)C)=O

InChI

InChI=1S/C20H26NO4P/c1-16(2)24-26(23,25-17(3)4)15-20(22)21(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,16-17H,15H2,1-4H3

InChI Key

BMVYNPXYSNERFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03133485

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.070

Distribution Coefficient, logD

3.070

Water Solubility, LogSw

-3.23

Polar Surface Area

43.863

Acid Dissociation Constant (pKa)

18.82

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with 8012-8101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-8101?
Check Price and Availability of 8012-8101, 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 8012-8101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-8101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-8101
  • 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 8012-8101 available by request