G729-0049 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2-methoxyethyl)propanamide

G729-0049 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2-methoxyethyl)propanamide
G729-0049 Screening compound: 3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2-methoxyethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G729-0049
3-{3-[(benzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2-methoxyethyl)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

G729-0049

Molecular Formula

C15H19N3O5S (C15 H19 N3 O5 S)

Compound Name

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

IUPAC name

3-{3-[(benzenesulfonyl)methyl]-124-oxadiazol-5-yl}-N-(2-methoxyethyl)propanamide

SMILES

COCCNC(CCc1nc(CS(c2ccccc2)(=O)=O)no1)=O

InChI

InChI=1S/C15H19N3O5S/c1-22-10-9-16-14(19)7-8-15-17-13(18-23-15)11-24(20,21)12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,16,19)

InChI Key

KTMHENFDAFYICE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27154517

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.4

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

0.233

Distribution Coefficient, logD

0.233

Water Solubility, LogSw

-2.20

Polar Surface Area

94.264

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G729-0049 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G729-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G729-0049?
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What is the minimum amount of G729-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G729-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G729-0049
  • 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 G729-0049 available by request