G729-0614 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,3-dimethylphenyl)propanamide

G729-0614 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,3-dimethylphenyl)propanamide
G729-0614 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,3-dimethylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G729-0614
3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,3-dimethylphenyl)propanamide

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

G729-0614

Molecular Formula

C20H20ClN3O4S (C20 H20 ClN3 O4 S)

Compound Name

3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,3-dimethylphenyl)propanamide

IUPAC name

3-{3-[(4-chlorobenzenesulfonyl)methyl]-124-oxadiazol-5-yl}-N-(23-dimethylphenyl)propanamide

SMILES

Cc1cccc(NC(CCc2nc(CS(c(cc3)ccc3Cl)(=O)=O)no2)=O)c1C

InChI

InChI=1S/C20H20ClN3O4S/c1-13-4-3-5-17(14(13)2)22-19(25)10-11-20-23-18(24-28-20)12-29(26,27)16-8-6-15(21)7-9-16/h3-9H,10-12H2,1-2H3,(H,22,25)

InChI Key

KYMPLFWGBZZVDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27154551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.92

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.609

Distribution Coefficient, logD

3.609

Water Solubility, LogSw

-3.97

Polar Surface Area

83.788

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with G729-0614 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G729-0614?
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What is the minimum amount of G729-0614 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G729-0614
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G729-0614
  • 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 G729-0614 available by request