D320-0319 Screening compound: 4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide

D320-0319 Screening compound: 4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide
D320-0319 Screening compound: 4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D320-0319
4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide

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

D320-0319

Molecular Formula

C18H15F3N4O2 (C18 H15 F3 N4 O2)

Compound Name

4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide

IUPAC name

4-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]butanamide

SMILES

O=C(CCCc1nc(-c2ccncc2)no1)Nc1cccc(C(F)(F)F)c1

InChI

InChI=1S/C18H15F3N4O2/c19-18(20,21)13-3-1-4-14(11-13)23-15(26)5-2-6-16-24-17(25-27-16)12-7-9-22-10-8-12/h1,3-4,7-11H,2,5-6H2,(H,23,26)

InChI Key

YZPMWTFWGLMLLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.34

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

3.615

Distribution Coefficient, logD

3.614

Water Solubility, LogSw

-3.77

Polar Surface Area

63.887

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

D320-0319 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D320-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D320-0319?
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What is the minimum amount of D320-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D320-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D320-0319
  • 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 D320-0319 available by request