3701-0079 Screening compound: [(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]amine

3701-0079 Screening compound: [(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]amine
3701-0079 Screening compound: [(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3701-0079
[(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]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

3701-0079

Molecular Formula

C17H21NO2 (C17 H21 NO2)

Compound Name

[(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]amine

IUPAC name

[(4-ethoxyphenyl)methyl][(2-methoxyphenyl)methyl]amine

SMILES

CCOc1ccc(CNCc(cccc2)c2OC)cc1

InChI

InChI=1S/C17H21NO2/c1-3-20-16-10-8-14(9-11-16)12-18-13-15-6-4-5-7-17(15)19-2/h4-11,18H,3,12-13H2,1-2H3

InChI Key

NVRCYCNSEDFZIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107042

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

271.36

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

3.415

Distribution Coefficient, logD

2.274

Water Solubility, LogSw

-3.32

Polar Surface Area

26.758

Acid Dissociation Constant (pKa)

26.21

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

3701-0079 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3701-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3701-0079?
Check Price and Availability of 3701-0079, 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 3701-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3701-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3701-0079
  • 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 3701-0079 available by request