G585-0810 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide

G585-0810 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide
G585-0810 Screening compound: 1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G585-0810
1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide

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

G585-0810

Molecular Formula

C23H29N3O4S2 (C23 H29 N3 O4 S2)

Compound Name

1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide

IUPAC name

1-[(1-ethyl-1H-indol-5-yl)sulfonyl]-N-(2-{[(furan-2-yl)methyl]sulfanyl}ethyl)piperidine-4-carboxamide

SMILES

CCn(cc1)c(cc2)c1cc2S(N(CC1)CCC1C(NCCSCc1ccco1)=O)(=O)=O

InChI

InChI=1S/C23H29N3O4S2/c1-2-25-11-7-19-16-21(5-6-22(19)25)32(28,29)26-12-8-18(9-13-26)23(27)24-10-15-31-17-20-4-3-14-30-20/h3-7,11,14,16,18H,2,8-10,12-13,15,17H2,1H3,(H,24,27)

InChI Key

JOBLUMUNCOWXIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15020960

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.232

Distribution Coefficient, logD

3.232

Water Solubility, LogSw

-3.41

Polar Surface Area

65.788

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

G585-0810 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

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 G585-0810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G585-0810?
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What is the minimum amount of G585-0810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G585-0810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G585-0810
  • 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 G585-0810 available by request