L233-1581 Screening compound: ethyl 1-({5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate

L233-1581 Screening compound: ethyl 1-({5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate
L233-1581 Screening compound: ethyl 1-({5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L233-1581
ethyl 1-({5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate

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

L233-1581

Molecular Formula

C21H22FN3O5S2 (C21 H22 FN3 O5 S2)

Compound Name

ethyl 1-({5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate

IUPAC name

ethyl 1-({5-[3-(3-fluorophenyl)-124-oxadiazol-5-yl]-2-methylthiophen-3-yl}sulfonyl)piperidine-2-carboxylate

SMILES

CCOC(C(CCCC1)N1S(c1c(C)sc(-c2nc(-c3cc(F)ccc3)no2)c1)(=O)=O)=O

InChI

InChI=1S/C21H22FN3O5S2/c1-3-29-21(26)16-9-4-5-10-25(16)32(27,28)18-12-17(31-13(18)2)20-23-19(24-30-20)14-7-6-8-15(22)11-14/h6-8,11-12,16H,3-5,9-10H2,1-2H3/t16-/m0/s1

InChI Key

RTKDDOATQZDDER-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27237406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.989

Distribution Coefficient, logD

4.989

Water Solubility, LogSw

-4.69

Polar Surface Area

85.598

Acid Dissociation Constant (pKa)

20.73

Base Dissociation Constant (pKb)

-5.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

L233-1581 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L233-1581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L233-1581?
Check Price and Availability of L233-1581, 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 L233-1581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L233-1581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L233-1581
  • 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 L233-1581 available by request