8019-1268 Screening compound: ethyl 2-acetamido-3,3,3-trifluoro-2-[(3-methylphenyl)amino]propanoate

8019-1268 Screening compound: ethyl 2-acetamido-3,3,3-trifluoro-2-[(3-methylphenyl)amino]propanoate
8019-1268 Screening compound: ethyl 2-acetamido-3,3,3-trifluoro-2-[(3-methylphenyl)amino]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-1268
ethyl 2-acetamido-3,3,3-trifluoro-2-[(3-methylphenyl)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

8019-1268

Molecular Formula

C14H17F3N2O3 (C14 H17 F3 N2 O3)

Compound Name

ethyl 2-acetamido-3,3,3-trifluoro-2-[(3-methylphenyl)amino]propanoate

IUPAC name

ethyl 2-acetamido-333-trifluoro-2-[(3-methylphenyl)amino]propanoate

SMILES

CCOC(C(C(F)(F)F)(NC(C)=O)Nc1cc(C)ccc1)=O

InChI

InChI=1S/C14H17F3N2O3/c1-4-22-12(21)13(14(15,16)17,18-10(3)20)19-11-7-5-6-9(2)8-11/h5-8,19H,4H2,1-3H3,(H,18,20)/t13-/m1/s1

InChI Key

RFLZWVFKGAFWJI-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD00275948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.821

Distribution Coefficient, logD

2.714

Water Solubility, LogSw

-3.01

Polar Surface Area

54.451

Acid Dissociation Constant (pKa)

7.95

Base Dissociation Constant (pKb)

-2.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with 8019-1268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-1268?
Check Price and Availability of 8019-1268, 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 8019-1268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-1268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-1268
  • 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 8019-1268 available by request