G729-0188 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(3-methoxyphenyl)methyl]propanamide

G729-0188 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(3-methoxyphenyl)methyl]propanamide
G729-0188 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(3-methoxyphenyl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G729-0188
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[(3-methoxyphenyl)methyl]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

G729-0188

Molecular Formula

C20H21N3O5S (C20 H21 N3 O5 S)

Compound Name

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

IUPAC name

3-{3-[(benzenesulfonyl)methyl]-124-oxadiazol-5-yl}-N-[(3-methoxyphenyl)methyl]propanamide

SMILES

COc1cccc(CNC(CCc2nc(CS(c3ccccc3)(=O)=O)no2)=O)c1

InChI

InChI=1S/C20H21N3O5S/c1-27-16-7-5-6-15(12-16)13-21-19(24)10-11-20-22-18(23-28-20)14-29(25,26)17-8-3-2-4-9-17/h2-9,12H,10-11,13-14H2,1H3,(H,21,24)

InChI Key

NXSHYYHDYYULTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15030254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.996

Distribution Coefficient, logD

1.996

Water Solubility, LogSw

-2.66

Polar Surface Area

93.352

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with G729-0188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G729-0188?
Check Price and Availability of G729-0188, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G729-0188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G729-0188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G729-0188
  • 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 G729-0188 available by request