3624-0106 Screening compound: N1,N3-bis(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,3-dicarboxamide

3624-0106 Screening compound: N1,N3-bis(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,3-dicarboxamide
3624-0106 Screening compound: N1,N3-bis(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3624-0106
N1,N3-bis(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,3-dicarboxamide

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

3624-0106

Molecular Formula

C24H20N2O6 (C24 H20 N2 O6)

Compound Name

N1,N3-bis(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,3-dicarboxamide

IUPAC name

N1N3-bis(23-dihydro-14-benzodioxin-6-yl)benzene-13-dicarboxamide

SMILES

O=C(c1cccc(C(Nc(cc2)cc3c2OCCO3)=O)c1)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C24H20N2O6/c27-23(25-17-4-6-19-21(13-17)31-10-8-29-19)15-2-1-3-16(12-15)24(28)26-18-5-7-20-22(14-18)32-11-9-30-20/h1-7,12-14H,8-11H2,(H,25,27)(H,26,28)

InChI Key

GBPSNGYZLNXBNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02054951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.858

Distribution Coefficient, logD

1.847

Water Solubility, LogSw

-2.41

Polar Surface Area

78.067

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

3624-0106 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3624-0106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3624-0106?
Check Price and Availability of 3624-0106, 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 3624-0106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3624-0106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3624-0106
  • 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 3624-0106 available by request