F071-0257 Screening compound: 2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)acetamide

F071-0257 Screening compound: 2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)acetamide
F071-0257 Screening compound: 2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F071-0257
2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)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

F071-0257

Molecular Formula

C22H21ClN6O3S (C22 H21 ClN6 O3 S)

Compound Name

2-{5-amino-4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)acetamide

IUPAC name

2-{5-amino-4-[3-(4-methylphenyl)-124-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(3-chloro-4-methoxyphenyl)acetamide

SMILES

Cc(cc1)ccc1-c1noc(-c2c(N)n(CC(Nc(cc3)cc(Cl)c3OC)=O)nc2SC)n1

InChI

InChI=1S/C22H21ClN6O3S/c1-12-4-6-13(7-5-12)20-26-21(32-28-20)18-19(24)29(27-22(18)33-3)11-17(30)25-14-8-9-16(31-2)15(23)10-14/h4-10H,11,24H2,1-3H3,(H,25,30)

InChI Key

KKTZCNKXWIWWQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27098813

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.719

Distribution Coefficient, logD

4.718

Water Solubility, LogSw

-5.00

Polar Surface Area

95.511

Acid Dissociation Constant (pKa)

10.63

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with F071-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F071-0257?
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What is the minimum amount of F071-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F071-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F071-0257
  • 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 F071-0257 available by request