G729-0621 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3-phenylpropyl)propanamide

G729-0621 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3-phenylpropyl)propanamide
G729-0621 Screening compound: 3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3-phenylpropyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G729-0621
3-{3-[(4-chlorobenzenesulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3-phenylpropyl)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

G729-0621

Molecular Formula

C21H22ClN3O4S (C21 H22 ClN3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCc1nc(CS(c(cc2)ccc2Cl)(=O)=O)no1)NCCCc1ccccc1

InChI

InChI=1S/C21H22ClN3O4S/c22-17-8-10-18(11-9-17)30(27,28)15-19-24-21(29-25-19)13-12-20(26)23-14-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-11H,4,7,12-15H2,(H,23,26)

InChI Key

MTORPJWBTKOPLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15030300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.94

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.430

Distribution Coefficient, logD

3.430

Water Solubility, LogSw

-3.87

Polar Surface Area

85.650

Acid Dissociation Constant (pKa)

14.73

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

G729-0621 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with G729-0621 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G729-0621?
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What is the minimum amount of G729-0621 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G729-0621
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G729-0621
  • 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 G729-0621 available by request