K781-1520 Screening compound: (2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate

K781-1520 Screening compound: (2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate
K781-1520 Screening compound: (2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-1520
(2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate

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

K781-1520

Molecular Formula

C28H24ClFN2O5S (C28 H24 ClFN2 O5 S)

Compound Name

(2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate

IUPAC name

(2-fluorophenyl)methyl 4-{[(2-chlorophenyl)methyl]amino}-3-[(3-methoxyphenyl)sulfamoyl]benzoate

SMILES

COc1cccc(NS(c(cc(cc2)C(OCc(cccc3)c3F)=O)c2NCc(cccc2)c2Cl)(=O)=O)c1

InChI

InChI=1S/C28H24ClFN2O5S/c1-36-23-10-6-9-22(16-23)32-38(34,35)27-15-19(28(33)37-18-21-8-3-5-12-25(21)30)13-14-26(27)31-17-20-7-2-4-11-24(20)29/h2-16,31-32H,17-18H2,1H3

InChI Key

PPAJVLSTTFSEJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02936666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

555.03

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.501

Distribution Coefficient, logD

6.060

Water Solubility, LogSw

-6.24

Polar Surface Area

78.826

Acid Dissociation Constant (pKa)

7.15

Base Dissociation Constant (pKb)

-4.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.70

K781-1520 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with K781-1520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-1520?
Check Price and Availability of K781-1520, 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 K781-1520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-1520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-1520
  • 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 K781-1520 available by request