3381-1346 Screening compound: [(2,6-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine

3381-1346 Screening compound: [(2,6-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine
3381-1346 Screening compound: [(2,6-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-1346
[(2,6-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine

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

3381-1346

Molecular Formula

C16H17F2NO (C16 H17 F2 NO)

Compound Name

[(2,6-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine

IUPAC name

[(26-difluorophenyl)methyl][2-(3-methoxyphenyl)ethyl]amine

SMILES

COc1cccc(CCNCc(c(F)ccc2)c2F)c1

InChI

InChI=1S/C16H17F2NO/c1-20-13-5-2-4-12(10-13)8-9-19-11-14-15(17)6-3-7-16(14)18/h2-7,10,19H,8-9,11H2,1H3

InChI Key

KAXAHEQYXOJICY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01135296

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

277.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.878

Distribution Coefficient, logD

2.189

Water Solubility, LogSw

-3.33

Polar Surface Area

19.389

Acid Dissociation Constant (pKa)

26.15

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

3381-1346 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3381-1346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-1346?
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What is the minimum amount of 3381-1346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-1346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-1346
  • 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 3381-1346 available by request