4146-0615 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-(3,4-dimethoxyphenyl)acetamide

4146-0615 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-(3,4-dimethoxyphenyl)acetamide
4146-0615 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-(3,4-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4146-0615
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-(3,4-dimethoxyphenyl)acetamide

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

4146-0615

Molecular Formula

C19H21NO5 (C19 H21 NO5)

Compound Name

N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-(3,4-dimethoxyphenyl)acetamide

IUPAC name

N-[(23-dihydro-14-benzodioxin-2-yl)methyl]-2-(34-dimethoxyphenyl)acetamide

SMILES

COc(ccc(CC(NCC1Oc(cccc2)c2OC1)=O)c1)c1OC

InChI

InChI=1S/C19H21NO5/c1-22-15-8-7-13(9-18(15)23-2)10-19(21)20-11-14-12-24-16-5-3-4-6-17(16)25-14/h3-9,14H,10-12H2,1-2H3,(H,20,21)/t14-/m0/s1

InChI Key

WZWNFJFHJBTUGW-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD02030140

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.959

Distribution Coefficient, logD

1.959

Water Solubility, LogSw

-2.47

Polar Surface Area

55.379

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

-1.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

4146-0615 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4146-0615 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4146-0615?
Check Price and Availability of 4146-0615, 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 4146-0615 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4146-0615
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4146-0615
  • 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 4146-0615 available by request