4487-1281 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2,4-dichlorophenoxy)butanamide

4487-1281 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2,4-dichlorophenoxy)butanamide
4487-1281 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2,4-dichlorophenoxy)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4487-1281
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2,4-dichlorophenoxy)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

4487-1281

Molecular Formula

C17H13Cl3F3NO2 (C17 H13 Cl3 F3 NO2)

Compound Name

N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2,4-dichlorophenoxy)butanamide

IUPAC name

N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(24-dichlorophenoxy)butanamide

SMILES

O=C(CCCOc(ccc(Cl)c1)c1Cl)Nc(cc(C(F)(F)F)cc1)c1Cl

InChI

InChI=1S/C17H13Cl3F3NO2/c18-11-4-6-15(13(20)9-11)26-7-1-2-16(25)24-14-8-10(17(21,22)23)3-5-12(14)19/h3-6,8-9H,1-2,7H2,(H,24,25)

InChI Key

RVAJUBYFJPAHKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00784121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.65

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.461

Distribution Coefficient, logD

5.401

Water Solubility, LogSw

-6.04

Polar Surface Area

29.923

Acid Dissociation Constant (pKa)

8.23

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 4487-1281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4487-1281?
Check Price and Availability of 4487-1281, 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 4487-1281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4487-1281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4487-1281
  • 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 4487-1281 available by request