7202-3477 Screening compound: N-(3,4-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)butanamide

7202-3477 Screening compound: N-(3,4-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)butanamide
7202-3477 Screening compound: N-(3,4-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7202-3477
N-(3,4-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)butanamide

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

7202-3477

Molecular Formula

C19H19NO7S2 (C19 H19 NO7 S2)

Compound Name

N-(3,4-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)butanamide

IUPAC name

N-(34-dimethoxybenzenesulfonyl)-N-(2-oxo-2H-13-benzoxathiol-5-yl)butanamide

SMILES

CCCC(N(c(cc1)cc(S2)c1OC2=O)S(c(cc1)cc(OC)c1OC)(=O)=O)=O

InChI

InChI=1S/C19H19NO7S2/c1-4-5-18(21)20(12-6-8-15-17(10-12)28-19(22)27-15)29(23,24)13-7-9-14(25-2)16(11-13)26-3/h6-11H,4-5H2,1-3H3

InChI Key

ONJTVJMLSCOVIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05804797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.49

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.136

Distribution Coefficient, logD

3.136

Water Solubility, LogSw

-3.45

Polar Surface Area

82.623

Acid Dissociation Constant (pKa)

20.98

Base Dissociation Constant (pKb)

-13.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

7202-3477 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 7202-3477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7202-3477?
Check Price and Availability of 7202-3477, 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 7202-3477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7202-3477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7202-3477
  • 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 7202-3477 available by request