6408-0633 Screening compound: N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide

6408-0633 Screening compound: N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide
6408-0633 Screening compound: N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6408-0633
N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide

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

6408-0633

Molecular Formula

C21H25F3N2O3 (C21 H25 F3 N2 O3)

Compound Name

N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide

IUPAC name

N-tert-butyl-2-[2-methoxy-4-({[3-(trifluoromethyl)phenyl]amino}methyl)phenoxy]acetamide

SMILES

CC(C)(C)NC(COc(ccc(CNc1cccc(C(F)(F)F)c1)c1)c1OC)=O

InChI

InChI=1S/C21H25F3N2O3/c1-20(2,3)26-19(27)13-29-17-9-8-14(10-18(17)28-4)12-25-16-7-5-6-15(11-16)21(22,23)24/h5-11,25H,12-13H2,1-4H3,(H,26,27)

InChI Key

KEJNHJDWQNWQMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04090320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.232

Distribution Coefficient, logD

4.232

Water Solubility, LogSw

-4.50

Polar Surface Area

48.984

Acid Dissociation Constant (pKa)

15.22

Base Dissociation Constant (pKb)

7.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

6408-0633 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 6408-0633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6408-0633?
Check Price and Availability of 6408-0633, 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 6408-0633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6408-0633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6408-0633
  • 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 6408-0633 available by request