G779-0680 Screening compound: 3-(3-{1-[(4-chlorophenyl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-1,2,4-oxadiazol-5-yl)-N-cyclopentylpropanamide

G779-0680 Screening compound: 3-(3-{1-[(4-chlorophenyl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-1,2,4-oxadiazol-5-yl)-N-cyclopentylpropanamide
G779-0680 Screening compound: 3-(3-{1-[(4-chlorophenyl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-1,2,4-oxadiazol-5-yl)-N-cyclopentylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G779-0680
3-(3-{1-[(4-chlorophenyl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-1,2,4-oxadiazol-5-yl)-N-cyclopentylpropanamide

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

G779-0680

Molecular Formula

C22H27ClN4O2 (C22 H27 ClN4 O2)

Compound Name

3-(3-{1-[(4-chlorophenyl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-1,2,4-oxadiazol-5-yl)-N-cyclopentylpropanamide

IUPAC name

3-(3-{1-[(4-chlorophenyl)methyl]-1236-tetrahydropyridin-4-yl}-124-oxadiazol-5-yl)-N-cyclopentylpropanamide

SMILES

O=C(CCc1nc(C2=CCN(Cc(cc3)ccc3Cl)CC2)no1)NC1CCCC1

InChI

InChI=1S/C22H27ClN4O2/c23-18-7-5-16(6-8-18)15-27-13-11-17(12-14-27)22-25-21(29-26-22)10-9-20(28)24-19-3-1-2-4-19/h5-8,11,19H,1-4,9-10,12-15H2,(H,24,28)

InChI Key

LNNOVVRMYBPBHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15035493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.93

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.117

Distribution Coefficient, logD

4.099

Water Solubility, LogSw

-4.47

Polar Surface Area

59.605

Acid Dissociation Constant (pKa)

16.14

Base Dissociation Constant (pKb)

6.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G779-0680 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G779-0680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G779-0680?
Check Price and Availability of G779-0680, 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 G779-0680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G779-0680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G779-0680
  • 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 G779-0680 available by request