D468-1934 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)acetamide

D468-1934 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)acetamide
D468-1934 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D468-1934
N-(2,1,3-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)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

D468-1934

Molecular Formula

C15H13N3O3S (C15 H13 N3 O3 S)

Compound Name

N-(2,1,3-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)acetamide

IUPAC name

N-(213-benzothiadiazol-5-yl)-2-(4-methoxyphenoxy)acetamide

SMILES

COc(cc1)ccc1OCC(Nc1cc2nsnc2cc1)=O

InChI

InChI=1S/C15H13N3O3S/c1-20-11-3-5-12(6-4-11)21-9-15(19)16-10-2-7-13-14(8-10)18-22-17-13/h2-8H,9H2,1H3,(H,16,19)

InChI Key

HMYYNBYZCIYQPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12920040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.313

Distribution Coefficient, logD

3.312

Water Solubility, LogSw

-3.68

Polar Surface Area

58.341

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

D468-1934 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D468-1934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D468-1934?
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What is the minimum amount of D468-1934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D468-1934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D468-1934
  • 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 D468-1934 available by request