P018-1054 Screening compound: N-({5-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide

P018-1054 Screening compound: N-({5-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide
P018-1054 Screening compound: N-({5-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P018-1054
N-({5-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide

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

P018-1054

Molecular Formula

C16H15N3O2S2 (C16 H15 N3 O2 S2)

Compound Name

N-({5-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide

IUPAC name

N-({5-[3-(thiophen-2-yl)-124-oxadiazol-5-yl]thiophen-2-yl}methyl)cyclobutanecarboxamide

SMILES

O=C(C1CCC1)NCc1ccc(-c2nc(-c3cccs3)no2)s1

InChI

InChI=1S/C16H15N3O2S2/c20-15(10-3-1-4-10)17-9-11-6-7-13(23-11)16-18-14(19-21-16)12-5-2-8-22-12/h2,5-8,10H,1,3-4,9H2,(H,17,20)

InChI Key

FTMAAQKMZVCNJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27558717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.422

Distribution Coefficient, logD

3.422

Water Solubility, LogSw

-3.49

Polar Surface Area

58.617

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

P018-1054 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P018-1054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P018-1054?
Check Price and Availability of P018-1054, 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 P018-1054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P018-1054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P018-1054
  • 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 P018-1054 available by request