8015-4848 Screening compound: N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4-dimethoxy-N~1~-methyl-1-benzenesulfonamide

8015-4848 Screening compound: N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4-dimethoxy-N~1~-methyl-1-benzenesulfonamide
8015-4848 Screening compound: N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4-dimethoxy-N~1~-methyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-4848
N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4-dimethoxy-N~1~-methyl-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

8015-4848

Molecular Formula

C13H19NO6S2 (C13 H19 NO6 S2)

Compound Name

N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-3,4-dimethoxy-N~1~-methyl-1-benzenesulfonamide

IUPAC name

N-(11-dioxo-1lambda6-thiolan-3-yl)-34-dimethoxy-N-methylbenzene-1-sulfonamide

SMILES

CN(C(CC1)CS1(=O)=O)S(c(cc1)cc(OC)c1OC)(=O)=O

InChI

InChI=1S/C13H19NO6S2/c1-14(10-6-7-21(15,16)9-10)22(17,18)11-4-5-12(19-2)13(8-11)20-3/h4-5,8,10H,6-7,9H2,1-3H3/t10-/m1/s1

InChI Key

BZFIDXXWDJUCFS-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD04061735

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.43

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.213

Distribution Coefficient, logD

0.213

Water Solubility, LogSw

-2.12

Polar Surface Area

76.591

Acid Dissociation Constant (pKa)

20.12

Base Dissociation Constant (pKb)

-6.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.85

8015-4848 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Dark Chemical Matter Library (18430 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 8015-4848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-4848?
Check Price and Availability of 8015-4848, 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 8015-4848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-4848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-4848
  • 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 8015-4848 available by request