8018-8986 Screening compound: ethyl 3,3,3-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]amino}propanoate

8018-8986 Screening compound: ethyl 3,3,3-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]amino}propanoate
8018-8986 Screening compound: ethyl 3,3,3-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]amino}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8986
ethyl 3,3,3-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]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

8018-8986

Molecular Formula

C15H16F6N2O3 (C15 H16 F6 N2 O3)

Compound Name

ethyl 3,3,3-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]amino}propanoate

IUPAC name

ethyl 333-trifluoro-2-propanamido-2-{[3-(trifluoromethyl)phenyl]amino}propanoate

SMILES

CCC(NC(C(F)(F)F)(C(OCC)=O)Nc1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C15H16F6N2O3/c1-3-11(24)23-13(15(19,20)21,12(25)26-4-2)22-10-7-5-6-9(8-10)14(16,17)18/h5-8,22H,3-4H2,1-2H3,(H,23,24)/t13-/m0/s1

InChI Key

SDYVKNAVQFHCGS-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD00369234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.007

Distribution Coefficient, logD

3.831

Water Solubility, LogSw

-4.10

Polar Surface Area

54.339

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

-3.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

References: we are preparing a list of scientific research reports with 8018-8986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8986?
Check Price and Availability of 8018-8986, 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 8018-8986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8986
  • 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 8018-8986 available by request