7287-0509 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide

7287-0509 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide
7287-0509 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7287-0509
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide

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

7287-0509

Molecular Formula

C16H16ClNO5S (C16 H16 ClNO5 S)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-5-chloro-2-ethoxybenzene-1-sulfonamide

SMILES

CCOc(ccc(Cl)c1)c1S(NCc(cc1)cc2c1OCO2)(=O)=O

InChI

InChI=1S/C16H16ClNO5S/c1-2-21-14-6-4-12(17)8-16(14)24(19,20)18-9-11-3-5-13-15(7-11)23-10-22-13/h3-8,18H,2,9-10H2,1H3

InChI Key

FPDFYWLPBBHWLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01173231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.476

Distribution Coefficient, logD

3.476

Water Solubility, LogSw

-3.59

Polar Surface Area

66.322

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

-4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

7287-0509 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Antimitotic Tubulin Library (17355 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7287-0509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7287-0509?
Check Price and Availability of 7287-0509, 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 7287-0509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7287-0509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7287-0509
  • 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 7287-0509 available by request