6133-0033 Screening compound: 4-methoxy-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)-1-benzenesulfonamide

6133-0033 Screening compound: 4-methoxy-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)-1-benzenesulfonamide
6133-0033 Screening compound: 4-methoxy-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6133-0033
4-methoxy-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)-1-benzenesulfonamide

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

6133-0033

Molecular Formula

C20H17NO5S (C20 H17 NO5 S)

Compound Name

4-methoxy-N~1~-(2-methoxydibenzo[b,d]furan-3-yl)-1-benzenesulfonamide

IUPAC name

4-methoxy-N-{4-methoxy-8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaen-5-yl}benzene-1-sulfonamide

SMILES

COc(cc1)ccc1S(Nc(cc1oc(cccc2)c2c1c1)c1OC)(=O)=O

InChI

InChI=1S/C20H17NO5S/c1-24-13-7-9-14(10-8-13)27(22,23)21-17-12-19-16(11-20(17)25-2)15-5-3-4-6-18(15)26-19/h3-12,21H,1-2H3

InChI Key

DVZYPLKVTWKJGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01482172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.774

Distribution Coefficient, logD

4.744

Water Solubility, LogSw

-4.87

Polar Surface Area

63.279

Acid Dissociation Constant (pKa)

8.54

Base Dissociation Constant (pKb)

-9.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

6133-0033 in Drug Discovery

Included in Screening Libraries

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:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 6133-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6133-0033?
Check Price and Availability of 6133-0033, 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 6133-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6133-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6133-0033
  • 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 6133-0033 available by request