4192-0310 Screening compound: 4-[(E)-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]imino}methyl]-N,N-dimethylaniline

4192-0310 Screening compound: 4-[(E)-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]imino}methyl]-N,N-dimethylaniline
4192-0310 Screening compound: 4-[(E)-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]imino}methyl]-N,N-dimethylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4192-0310
4-[(E)-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]imino}methyl]-N,N-dimethylaniline

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

4192-0310

Molecular Formula

C18H20N2O2 (C18 H20 N2 O2)

Compound Name

4-[(E)-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]imino}methyl]-N,N-dimethylaniline

IUPAC name

4-[(E)-{[(23-dihydro-14-benzodioxin-2-yl)methyl]imino}methyl]-NN-dimethylaniline

SMILES

CN(C)c1ccc(/C=N/CC2Oc(cccc3)c3OC2)cc1

InChI

InChI=1S/C18H20N2O2/c1-20(2)15-9-7-14(8-10-15)11-19-12-16-13-21-17-5-3-4-6-18(17)22-16/h3-11,16H,12-13H2,1-2H3/t16-/m0/s1

InChI Key

BBUGRZJWRBZPMS-INIZCTEOSA-N

MDL Number (MFCD)

MFCD02048697

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.286

Distribution Coefficient, logD

3.093

Water Solubility, LogSw

-3.47

Polar Surface Area

27.384

Acid Dissociation Constant (pKa)

28.17

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

4192-0310 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4192-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4192-0310?
Check Price and Availability of 4192-0310, 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 4192-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4192-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4192-0310
  • 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 4192-0310 available by request