8018-7142 Screening compound: N-[4-(2H-1,3-benzodioxol-5-yloxy)phenyl]-2,6-dimethoxybenzamide

8018-7142 Screening compound: N-[4-(2H-1,3-benzodioxol-5-yloxy)phenyl]-2,6-dimethoxybenzamide
8018-7142 Screening compound: N-[4-(2H-1,3-benzodioxol-5-yloxy)phenyl]-2,6-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7142
N-[4-(2H-1,3-benzodioxol-5-yloxy)phenyl]-2,6-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

8018-7142

Molecular Formula

C22H19NO6 (C22 H19 NO6)

Compound Name

N-[4-(2H-1,3-benzodioxol-5-yloxy)phenyl]-2,6-dimethoxybenzamide

IUPAC name

N-[4-(2H-13-benzodioxol-5-yloxy)phenyl]-26-dimethoxybenzamide

SMILES

COc1cccc(OC)c1C(Nc(cc1)ccc1Oc(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C22H19NO6/c1-25-18-4-3-5-19(26-2)21(18)22(24)23-14-6-8-15(9-7-14)29-16-10-11-17-20(12-16)28-13-27-17/h3-12H,13H2,1-2H3,(H,23,24)

InChI Key

ONTZBDOTXRVPOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08142664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.912

Distribution Coefficient, logD

3.879

Water Solubility, LogSw

-4.40

Polar Surface Area

62.454

Acid Dissociation Constant (pKa)

8.50

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

8018-7142 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 8018-7142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7142?
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What is the minimum amount of 8018-7142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7142
  • 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 8018-7142 available by request