K784-6868 Screening compound: dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate

K784-6868 Screening compound: dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate
K784-6868 Screening compound: dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-6868
dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]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

K784-6868

Molecular Formula

C19H24FN2O3PS (C19 H24 FN2 O3 PS)

Compound Name

dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate

IUPAC name

dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate

SMILES

CCc(cccc1)c1NC(N(Cc(cc1)ccc1F)CP(OC)(OC)=O)=S

InChI

InChI=1S/C19H24FN2O3PS/c1-4-16-7-5-6-8-18(16)21-19(27)22(14-26(23,24-2)25-3)13-15-9-11-17(20)12-10-15/h5-12H,4,13-14H2,1-3H3,(H,21,27)

InChI Key

LGRREYDBSYFTEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03451766

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.686

Distribution Coefficient, logD

3.686

Water Solubility, LogSw

-3.83

Polar Surface Area

36.669

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with K784-6868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-6868?
Check Price and Availability of K784-6868, 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 K784-6868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-6868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-6868
  • 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 K784-6868 available by request