2248-0962 Screening compound: N-{3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl}-4-tert-butylbenzene-1-sulfonamide

2248-0962 Screening compound: N-{3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl}-4-tert-butylbenzene-1-sulfonamide
2248-0962 Screening compound: N-{3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl}-4-tert-butylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2248-0962
N-{3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl}-4-tert-butylbenzene-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

2248-0962

Molecular Formula

C25H25NO4S (C25 H25 NO4 S)

Compound Name

N-{3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl}-4-tert-butylbenzene-1-sulfonamide

IUPAC name

N-{3-acetyl-2-methylnaphtho[12-b]furan-5-yl}-4-tert-butylbenzene-1-sulfonamide

SMILES

CC(C)(C)c(cc1)ccc1S(Nc(c1ccccc11)cc2c1oc(C)c2C(C)=O)(=O)=O

InChI

InChI=1S/C25H25NO4S/c1-15(27)23-16(2)30-24-20-9-7-6-8-19(20)22(14-21(23)24)26-31(28,29)18-12-10-17(11-13-18)25(3,4)5/h6-14,26H,1-5H3

InChI Key

DSFQNOSQYVRWMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01165328

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.035

Distribution Coefficient, logD

6.019

Water Solubility, LogSw

-5.83

Polar Surface Area

61.926

Acid Dissociation Constant (pKa)

8.85

Base Dissociation Constant (pKb)

-8.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

2248-0962 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS targets activity set (6557 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 2248-0962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2248-0962?
Check Price and Availability of 2248-0962, 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 2248-0962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2248-0962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2248-0962
  • 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 2248-0962 available by request