F845-0082 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethylphenyl)-N-methylthiophene-3-sulfonamide

F845-0082 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethylphenyl)-N-methylthiophene-3-sulfonamide
F845-0082 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethylphenyl)-N-methylthiophene-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F845-0082
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethylphenyl)-N-methylthiophene-3-sulfonamide

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

F845-0082

Molecular Formula

C21H18ClN3O3S2 (C21 H18 ClN3 O3 S2)

Compound Name

2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3,4-dimethylphenyl)-N-methylthiophene-3-sulfonamide

IUPAC name

2-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]-N-(34-dimethylphenyl)-N-methylthiophene-3-sulfonamide

SMILES

Cc(cc1)c(C)cc1N(C)S(c1c(-c2nc(-c(cc3)ccc3Cl)no2)scc1)(=O)=O

InChI

InChI=1S/C21H18ClN3O3S2/c1-13-4-9-17(12-14(13)2)25(3)30(26,27)18-10-11-29-19(18)21-23-20(24-28-21)15-5-7-16(22)8-6-15/h4-12H,1-3H3

InChI Key

SZZCWXUYGKAEKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11997698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.98

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.805

Distribution Coefficient, logD

6.805

Water Solubility, LogSw

-6.65

Polar Surface Area

65.484

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

-4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with F845-0082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F845-0082?
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What is the minimum amount of F845-0082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F845-0082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F845-0082
  • 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 F845-0082 available by request