L802-0845 Screening compound: 2-(1,5-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-1,3-thiazole-4-carboxamide

L802-0845 Screening compound: 2-(1,5-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-1,3-thiazole-4-carboxamide
L802-0845 Screening compound: 2-(1,5-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L802-0845
2-(1,5-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-1,3-thiazole-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

L802-0845

Molecular Formula

C16H14FN3OS (C16 H14 FN3 OS)

Compound Name

2-(1,5-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-1,3-thiazole-4-carboxamide

IUPAC name

2-(15-dimethyl-1H-pyrrol-2-yl)-N-(4-fluorophenyl)-13-thiazole-4-carboxamide

SMILES

Cc1ccc(-c2nc(C(Nc(cc3)ccc3F)=O)cs2)n1C

InChI

InChI=1S/C16H14FN3OS/c1-10-3-8-14(20(10)2)16-19-13(9-22-16)15(21)18-12-6-4-11(17)5-7-12/h3-9H,1-2H3,(H,18,21)

InChI Key

FXYHFNDNVLPFPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27476149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.707

Distribution Coefficient, logD

3.707

Water Solubility, LogSw

-3.96

Polar Surface Area

35.320

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

L802-0845 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with L802-0845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L802-0845?
Check Price and Availability of L802-0845, 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 L802-0845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L802-0845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L802-0845
  • 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 L802-0845 available by request