4123-0112 Screening compound: [(5-methoxy-2-methylphenyl)methyl]dimethylamine

4123-0112 Screening compound: [(5-methoxy-2-methylphenyl)methyl]dimethylamine
4123-0112 Screening compound: [(5-methoxy-2-methylphenyl)methyl]dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4123-0112
[(5-methoxy-2-methylphenyl)methyl]dimethylamine

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

4123-0112

Molecular Formula

C11H17NO (C11 H17 NO)

Compound Name

[(5-methoxy-2-methylphenyl)methyl]dimethylamine

IUPAC name

[(5-methoxy-2-methylphenyl)methyl]dimethylamine

SMILES

Cc(cc1)c(CN(C)C)cc1OC

InChI

InChI=1S/C11H17NO/c1-9-5-6-11(13-4)7-10(9)8-12(2)3/h5-7H,8H2,1-4H3

InChI Key

CCFBQPPZPRKHKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02763608

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

179.26

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.468

Distribution Coefficient, logD

-0.223

Water Solubility, LogSw

-2.51

Polar Surface Area

11.669

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

10.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

4123-0112 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 4123-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4123-0112?
Check Price and Availability of 4123-0112, 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 4123-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4123-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4123-0112
  • 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 4123-0112 available by request