6294-0010 Screening compound: diethyl [(4-bromophenyl)(phenylamino)methyl]phosphonate

6294-0010 Screening compound: diethyl [(4-bromophenyl)(phenylamino)methyl]phosphonate
6294-0010 Screening compound: diethyl [(4-bromophenyl)(phenylamino)methyl]phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6294-0010
diethyl [(4-bromophenyl)(phenylamino)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

6294-0010

Molecular Formula

C17H21BrNO3P (C17 H21 BrNO3 P)

Compound Name

diethyl [(4-bromophenyl)(phenylamino)methyl]phosphonate

IUPAC name

diethyl [(4-bromophenyl)(phenylamino)methyl]phosphonate

SMILES

CCOP(C(c(cc1)ccc1Br)Nc1ccccc1)(OCC)=O

InChI

InChI=1S/C17H21BrNO3P/c1-3-21-23(20,22-4-2)17(14-10-12-15(18)13-11-14)19-16-8-6-5-7-9-16/h5-13,17,19H,3-4H2,1-2H3/t17-/m0/s1

InChI Key

RGMYQYJNWWXCHF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD01409325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.433

Distribution Coefficient, logD

4.433

Water Solubility, LogSw

-4.52

Polar Surface Area

40.115

Acid Dissociation Constant (pKa)

18.22

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with 6294-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6294-0010?
Check Price and Availability of 6294-0010, 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 6294-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6294-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6294-0010
  • 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 6294-0010 available by request