L802-0558 Screening compound: 1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-1,3-thiazole-4-carbonyl]piperazine

L802-0558 Screening compound: 1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-1,3-thiazole-4-carbonyl]piperazine
L802-0558 Screening compound: 1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-1,3-thiazole-4-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L802-0558
1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-1,3-thiazole-4-carbonyl]piperazine

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

L802-0558

Molecular Formula

C18H17N3O3S2 (C18 H17 N3 O3 S2)

Compound Name

1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-1,3-thiazole-4-carbonyl]piperazine

IUPAC name

1-(furan-2-carbonyl)-4-[2-(5-methylthiophen-2-yl)-13-thiazole-4-carbonyl]piperazine

SMILES

Cc1ccc(-c2nc(C(N(CC3)CCN3C(c3ccco3)=O)=O)cs2)s1

InChI

InChI=1S/C18H17N3O3S2/c1-12-4-5-15(26-12)16-19-13(11-25-16)17(22)20-6-8-21(9-7-20)18(23)14-3-2-10-24-14/h2-5,10-11H,6-9H2,1H3

InChI Key

BYXYIMJAANPONE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27476104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.229

Distribution Coefficient, logD

3.229

Water Solubility, LogSw

-3.17

Polar Surface Area

52.674

Acid Dissociation Constant (pKa)

29.37

Base Dissociation Constant (pKb)

-1.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

L802-0558 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 L802-0558 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L802-0558?
Check Price and Availability of L802-0558, 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 L802-0558 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L802-0558
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L802-0558
  • 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 L802-0558 available by request