D269-0098 Screening compound: N-(3-phenyl-1,2,4-thiadiazol-5-yl)-3-propoxybenzamide

D269-0098 Screening compound: N-(3-phenyl-1,2,4-thiadiazol-5-yl)-3-propoxybenzamide
D269-0098 Screening compound: N-(3-phenyl-1,2,4-thiadiazol-5-yl)-3-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D269-0098
N-(3-phenyl-1,2,4-thiadiazol-5-yl)-3-propoxybenzamide

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

D269-0098

Molecular Formula

C18H17N3O2S (C18 H17 N3 O2 S)

Compound Name

N-(3-phenyl-1,2,4-thiadiazol-5-yl)-3-propoxybenzamide

IUPAC name

N-(3-phenyl-124-thiadiazol-5-yl)-3-propoxybenzamide

SMILES

CCCOc1cccc(C(Nc2nc(-c3ccccc3)ns2)=O)c1

InChI

InChI=1S/C18H17N3O2S/c1-2-11-23-15-10-6-9-14(12-15)17(22)20-18-19-16(21-24-18)13-7-4-3-5-8-13/h3-10,12H,2,11H2,1H3,(H,19,20,21,22)

InChI Key

MLWRAPXEGJWDJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08545906

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.966

Distribution Coefficient, logD

4.965

Water Solubility, LogSw

-4.60

Polar Surface Area

51.335

Acid Dissociation Constant (pKa)

9.92

Base Dissociation Constant (pKb)

-4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D269-0098 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D269-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D269-0098?
Check Price and Availability of D269-0098, 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 D269-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D269-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D269-0098
  • 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 D269-0098 available by request