P498-0479 Screening compound: 1-[3-(4-fluorophenyl)-1,2-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

P498-0479 Screening compound: 1-[3-(4-fluorophenyl)-1,2-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine
P498-0479 Screening compound: 1-[3-(4-fluorophenyl)-1,2-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound P498-0479
1-[3-(4-fluorophenyl)-1,2-thiazole-5-carbonyl]-4-(2-methoxyphenyl)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

P498-0479

Molecular Formula

C21H20FN3O2S (C21 H20 FN3 O2 S)

Compound Name

1-[3-(4-fluorophenyl)-1,2-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

IUPAC name

1-[3-(4-fluorophenyl)-12-thiazole-5-carbonyl]-4-(2-methoxyphenyl)piperazine

SMILES

COc(cccc1)c1N(CC1)CCN1C(c1cc(-c(cc2)ccc2F)ns1)=O

InChI

InChI=1S/C21H20FN3O2S/c1-27-19-5-3-2-4-18(19)24-10-12-25(13-11-24)21(26)20-14-17(23-28-20)15-6-8-16(22)9-7-15/h2-9,14H,10-13H2,1H3

InChI Key

NGDZOKPVBLYTCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27576587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.475

Distribution Coefficient, logD

4.475

Water Solubility, LogSw

-4.30

Polar Surface Area

37.696

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with P498-0479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P498-0479?
Check Price and Availability of P498-0479, 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 P498-0479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P498-0479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P498-0479
  • 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 P498-0479 available by request