S230-0833 Screening compound: 2-methoxy-N~1~-[(3S,4S)-1-[(5-methyl-2-furyl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydro-3-pyridinyl]acetamide

S230-0833 Screening compound: 2-methoxy-N~1~-[(3S,4S)-1-[(5-methyl-2-furyl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydro-3-pyridinyl]acetamide
S230-0833 Screening compound: 2-methoxy-N~1~-[(3S,4S)-1-[(5-methyl-2-furyl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydro-3-pyridinyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S230-0833
2-methoxy-N~1~-[(3S,4S)-1-[(5-methyl-2-furyl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydro-3-pyridinyl]acetamide

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

S230-0833

Molecular Formula

C17H24N4O4 (C17 H24 N4 O4)

Compound Name

2-methoxy-N~1~-[(3S,4S)-1-[(5-methyl-2-furyl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydro-3-pyridinyl]acetamide

IUPAC name

n/a

SMILES

Cc1ccc(CN(CC[C@H]2c3nc(C)no3)C[C@@H]2NC(COC)=O)o1

InChI

InChI=1S/C17H24N4O4/c1-11-4-5-13(24-11)8-21-7-6-14(17-18-12(2)20-25-17)15(9-21)19-16(22)10-23-3/h4-5,14-15H,6-10H2,1-3H3,(H,19,22)/t14-,15+/m1/s1

InChI Key

KGSDZRFGDHKIDS-CABCVRRESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.923

Distribution Coefficient, logD

0.474

Water Solubility, LogSw

-2.30

Polar Surface Area

75.276

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

7.66

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

58.80

S230-0833 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S230-0833 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S230-0833?
Check Price and Availability of S230-0833, 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 S230-0833 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S230-0833
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S230-0833
  • 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 S230-0833 available by request