5256-5303 Screening compound: N-[3-acetyl-1,1,1-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide

5256-5303 Screening compound: N-[3-acetyl-1,1,1-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide
5256-5303 Screening compound: N-[3-acetyl-1,1,1-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5256-5303
N-[3-acetyl-1,1,1-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide

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

5256-5303

Molecular Formula

C16H15F6NO4 (C16 H15 F6 NO4)

Compound Name

N-[3-acetyl-1,1,1-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide

IUPAC name

N-[3-acetyl-111-trifluoro-4-oxo-2-(trifluoromethyl)pentan-2-yl]-4-methoxybenzamide

SMILES

CC(C(C(C(F)(F)F)(C(F)(F)F)NC(c(cc1)ccc1OC)=O)C(C)=O)=O

InChI

InChI=1S/C16H15F6NO4/c1-8(24)12(9(2)25)14(15(17,18)19,16(20,21)22)23-13(26)10-4-6-11(27-3)7-5-10/h4-7,12H,1-3H3,(H,23,26)

InChI Key

CLQFMXLIGDMXLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03448711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.000

Distribution Coefficient, logD

-0.812

Water Solubility, LogSw

-3.39

Polar Surface Area

59.511

Acid Dissociation Constant (pKa)

3.59

Base Dissociation Constant (pKb)

-10.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with 5256-5303 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5256-5303?
Check Price and Availability of 5256-5303, 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 5256-5303 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5256-5303
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5256-5303
  • 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 5256-5303 available by request