5624-0931 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethoxybenzamide

5624-0931 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethoxybenzamide
5624-0931 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5624-0931
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethoxybenzamide

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

5624-0931

Molecular Formula

C17H17NO5 (C17 H17 NO5)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethoxybenzamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-35-dimethoxybenzamide

SMILES

COc1cc(C(Nc(cc2)cc3c2OCCO3)=O)cc(OC)c1

InChI

InChI=1S/C17H17NO5/c1-20-13-7-11(8-14(10-13)21-2)17(19)18-12-3-4-15-16(9-12)23-6-5-22-15/h3-4,7-10H,5-6H2,1-2H3,(H,18,19)

InChI Key

RSKSQSMKHRXHAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00495142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.259

Distribution Coefficient, logD

2.259

Water Solubility, LogSw

-2.96

Polar Surface Area

54.240

Acid Dissociation Constant (pKa)

11.12

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

5624-0931 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular

References: we are preparing a list of scientific research reports with 5624-0931 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5624-0931?
Check Price and Availability of 5624-0931, 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 5624-0931 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5624-0931
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5624-0931
  • 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 5624-0931 available by request