1732-0225 Screening compound: N-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)butanamide

1732-0225 Screening compound: N-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)butanamide
1732-0225 Screening compound: N-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1732-0225
N-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)butanamide

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

1732-0225

Molecular Formula

C13H13F6NO2 (C13 H13 F6 NO2)

Compound Name

N-(4-methoxyphenyl)-2,2-bis(trifluoromethyl)butanamide

IUPAC name

N-(4-methoxyphenyl)-22-bis(trifluoromethyl)butanamide

SMILES

CCC(C(F)(F)F)(C(F)(F)F)C(Nc(cc1)ccc1OC)=O

InChI

InChI=1S/C13H13F6NO2/c1-3-11(12(14,15)16,13(17,18)19)10(21)20-8-4-6-9(22-2)7-5-8/h4-7H,3H2,1-2H3,(H,20,21)

InChI Key

OYXMHTIPIZXYCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00541625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.189

Distribution Coefficient, logD

4.189

Water Solubility, LogSw

-4.20

Polar Surface Area

31.145

Acid Dissociation Constant (pKa)

11.69

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

1732-0225 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1732-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1732-0225?
Check Price and Availability of 1732-0225, 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 1732-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1732-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1732-0225
  • 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 1732-0225 available by request