5256-1318 Screening compound: ethyl 3,3,3-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate

5256-1318 Screening compound: ethyl 3,3,3-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate
5256-1318 Screening compound: ethyl 3,3,3-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5256-1318
ethyl 3,3,3-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate

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

5256-1318

Molecular Formula

C19H20F3N3O5S (C19 H20 F3 N3 O5 S)

Compound Name

ethyl 3,3,3-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate

IUPAC name

ethyl 333-trifluoro-2-(2-phenylacetamido)-2-[(4-sulfamoylphenyl)amino]propanoate

SMILES

CCOC(C(C(F)(F)F)(NC(Cc1ccccc1)=O)Nc(cc1)ccc1S(N)(=O)=O)=O

InChI

InChI=1S/C19H20F3N3O5S/c1-2-30-17(27)18(19(20,21)22,25-16(26)12-13-6-4-3-5-7-13)24-14-8-10-15(11-9-14)31(23,28)29/h3-11,24H,2,12H2,1H3,(H,25,26)(H2,23,28,29)/t18-/m0/s1

InChI Key

RMISTXHFFALBCR-SFHVURJKSA-N

MDL Number (MFCD)

MFCD03448703

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.335

Distribution Coefficient, logD

1.844

Water Solubility, LogSw

-2.76

Polar Surface Area

104.670

Acid Dissociation Constant (pKa)

7.08

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with 5256-1318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5256-1318?
Check Price and Availability of 5256-1318, 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 5256-1318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5256-1318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5256-1318
  • 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 5256-1318 available by request