P181-0656 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide

P181-0656 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide
P181-0656 Screening compound: 3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P181-0656
3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-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

P181-0656

Molecular Formula

C19H11ClFN3O2S (C19 H11 ClFN3 O2 S)

Compound Name

3-chloro-N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide

IUPAC name

3-chloro-N-{2-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]thiophen-3-yl}benzamide

SMILES

O=C(c1cccc(Cl)c1)Nc1c(-c2nc(-c(cc3)ccc3F)no2)scc1

InChI

InChI=1S/C19H11ClFN3O2S/c20-13-3-1-2-12(10-13)18(25)22-15-8-9-27-16(15)19-23-17(24-26-19)11-4-6-14(21)7-5-11/h1-10H,(H,22,25)

InChI Key

JZXMGRLAMYPQPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27568306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.511

Distribution Coefficient, logD

5.510

Water Solubility, LogSw

-6.00

Polar Surface Area

55.056

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

-5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

P181-0656 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P181-0656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P181-0656?
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What is the minimum amount of P181-0656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P181-0656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P181-0656
  • 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 P181-0656 available by request