3553-2177 Screening compound: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide

3553-2177 Screening compound: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide
3553-2177 Screening compound: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3553-2177
N-(2,1,3-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide

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

3553-2177

Molecular Formula

C14H10ClN3O2S (C14 H10 ClN3 O2 S)

Compound Name

N-(2,1,3-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide

IUPAC name

N-(213-benzothiadiazol-4-yl)-2-(4-chlorophenoxy)acetamide

SMILES

O=C(COc(cc1)ccc1Cl)Nc1cccc2nsnc12

InChI

InChI=1S/C14H10ClN3O2S/c15-9-4-6-10(7-5-9)20-8-13(19)16-11-2-1-3-12-14(11)18-21-17-12/h1-7H,8H2,(H,16,19)

InChI Key

BIIBYOJWXYJVBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02577053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.77

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.681

Distribution Coefficient, logD

3.681

Water Solubility, LogSw

-4.35

Polar Surface Area

50.870

Acid Dissociation Constant (pKa)

10.71

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

3553-2177 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3553-2177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3553-2177?
Check Price and Availability of 3553-2177, 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 3553-2177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3553-2177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3553-2177
  • 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 3553-2177 available by request