P498-0217 Screening compound: 3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-1,2-thiazole-5-carboxamide

P498-0217 Screening compound: 3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-1,2-thiazole-5-carboxamide
P498-0217 Screening compound: 3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-1,2-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P498-0217
3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-1,2-thiazole-5-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

P498-0217

Molecular Formula

C16H13FN2OS2 (C16 H13 FN2 OS2)

Compound Name

3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-1,2-thiazole-5-carboxamide

IUPAC name

3-(3-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-12-thiazole-5-carboxamide

SMILES

O=C(c1cc(-c2cc(F)ccc2)ns1)NCCc1cccs1

InChI

InChI=1S/C16H13FN2OS2/c17-12-4-1-3-11(9-12)14-10-15(22-19-14)16(20)18-7-6-13-5-2-8-21-13/h1-5,8-10H,6-7H2,(H,18,20)

InChI Key

XAIFAHZJKLCQME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27576555

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.030

Distribution Coefficient, logD

4.030

Water Solubility, LogSw

-4.24

Polar Surface Area

35.732

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

-2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

P498-0217 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P498-0217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P498-0217?
Check Price and Availability of P498-0217, 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 P498-0217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P498-0217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P498-0217
  • 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 P498-0217 available by request