3702-1002 Screening compound: benzyl[(4-methoxyphenyl)methyl]amine

3702-1002 Screening compound: benzyl[(4-methoxyphenyl)methyl]amine
3702-1002 Screening compound: benzyl[(4-methoxyphenyl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3702-1002
benzyl[(4-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

3702-1002

Molecular Formula

C15H17NO (C15 H17 NO)

Compound Name

benzyl[(4-methoxyphenyl)methyl]amine

IUPAC name

benzyl[(4-methoxyphenyl)methyl]amine

SMILES

COc1ccc(CNCc2ccccc2)cc1

InChI

InChI=1S/C15H17NO/c1-17-15-9-7-14(8-10-15)12-16-11-13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3

InChI Key

WZUBICZIDUTTNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01002920

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

227.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.842

Distribution Coefficient, logD

1.723

Water Solubility, LogSw

-3.14

Polar Surface Area

19.548

Acid Dissociation Constant (pKa)

26.21

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

3702-1002 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3702-1002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3702-1002?
Check Price and Availability of 3702-1002, 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 3702-1002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3702-1002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3702-1002
  • 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 3702-1002 available by request