D457-0322 Screening compound: N-[3-(3-methoxy-4-propoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide

D457-0322 Screening compound: N-[3-(3-methoxy-4-propoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide
D457-0322 Screening compound: N-[3-(3-methoxy-4-propoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D457-0322
N-[3-(3-methoxy-4-propoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide

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

D457-0322

Molecular Formula

C19H19N3O3S (C19 H19 N3 O3 S)

Compound Name

N-[3-(3-methoxy-4-propoxyphenyl)-1,2,4-thiadiazol-5-yl]benzamide

IUPAC name

N-[3-(3-methoxy-4-propoxyphenyl)-124-thiadiazol-5-yl]benzamide

SMILES

CCCOc(ccc(-c1nsc(NC(c2ccccc2)=O)n1)c1)c1OC

InChI

InChI=1S/C19H19N3O3S/c1-3-11-25-15-10-9-14(12-16(15)24-2)17-20-19(26-22-17)21-18(23)13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,20,21,22,23)

InChI Key

PDWWJHIYIVGWOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12920845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.571

Distribution Coefficient, logD

4.566

Water Solubility, LogSw

-4.45

Polar Surface Area

59.052

Acid Dissociation Constant (pKa)

9.31

Base Dissociation Constant (pKb)

-3.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D457-0322 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with D457-0322 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D457-0322?
Check Price and Availability of D457-0322, 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 D457-0322 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D457-0322
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D457-0322
  • 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 D457-0322 available by request