F034-0759 Screening compound: 2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide

F034-0759 Screening compound: 2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide
F034-0759 Screening compound: 2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F034-0759
2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]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

F034-0759

Molecular Formula

C19H18ClN3O3S (C19 H18 ClN3 O3 S)

Compound Name

2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide

IUPAC name

2-({[3-(4-chlorophenyl)-124-oxadiazol-5-yl]methyl}sulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide

SMILES

COc1cccc(CNC(CSCc2nc(-c(cc3)ccc3Cl)no2)=O)c1

InChI

InChI=1S/C19H18ClN3O3S/c1-25-16-4-2-3-13(9-16)10-21-17(24)11-27-12-18-22-19(23-26-18)14-5-7-15(20)8-6-14/h2-9H,10-12H2,1H3,(H,21,24)

InChI Key

YUPDJJSRSYRQGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27096072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.89

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.684

Distribution Coefficient, logD

4.684

Water Solubility, LogSw

-4.94

Polar Surface Area

63.325

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

-1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

F034-0759 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F034-0759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F034-0759?
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What is the minimum amount of F034-0759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F034-0759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F034-0759
  • 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 F034-0759 available by request