P019-0348 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}acetamide

P019-0348 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}acetamide
P019-0348 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P019-0348
N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}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

P019-0348

Molecular Formula

C19H18N4O4S (C19 H18 N4 O4 S)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(3-propyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}acetamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-2-{[3-(3-propyl-124-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}acetamide

SMILES

CCCc1noc(-c2cccnc2SCC(Nc(cc2)cc3c2OCO3)=O)n1

InChI

InChI=1S/C19H18N4O4S/c1-2-4-16-22-18(27-23-16)13-5-3-8-20-19(13)28-10-17(24)21-12-6-7-14-15(9-12)26-11-25-14/h3,5-9H,2,4,10-11H2,1H3,(H,21,24)

InChI Key

PYKCMMWVRFFTIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27558802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.494

Distribution Coefficient, logD

3.494

Water Solubility, LogSw

-3.76

Polar Surface Area

82.079

Acid Dissociation Constant (pKa)

11.53

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

P019-0348 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with P019-0348 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P019-0348?
Check Price and Availability of P019-0348, 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 P019-0348 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P019-0348
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P019-0348
  • 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 P019-0348 available by request