8005-9997 Screening compound: 4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline

8005-9997 Screening compound: 4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline
8005-9997 Screening compound: 4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-9997
4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline

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

8005-9997

Molecular Formula

C15H18N2O2 (C15 H18 N2 O2)

Compound Name

4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline

IUPAC name

4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline

SMILES

COc(cc(Cc(cc1)cc(OC)c1N)cc1)c1N

InChI

InChI=1S/C15H18N2O2/c1-18-14-8-10(3-5-12(14)16)7-11-4-6-13(17)15(9-11)19-2/h3-6,8-9H,7,16-17H2,1-2H3

InChI Key

LKHVCEWNPKEPBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00224334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.32

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.011

Distribution Coefficient, logD

2.003

Water Solubility, LogSw

-2.00

Polar Surface Area

55.420

Acid Dissociation Constant (pKa)

21.10

Base Dissociation Constant (pKb)

5.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8005-9997 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8005-9997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-9997?
Check Price and Availability of 8005-9997, 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 8005-9997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-9997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-9997
  • 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 8005-9997 available by request