F527-0681 Screening compound: N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide

F527-0681 Screening compound: N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide
F527-0681 Screening compound: N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F527-0681
N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide

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

F527-0681

Molecular Formula

C20H14ClFN4O2S (C20 H14 ClFN4 O2 S)

Compound Name

N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide

IUPAC name

N-{[2-(2-chlorophenyl)-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide

SMILES

Cc(ccc(C(NCC(N=C1SC(c(cccc2)c2Cl)=NN11)=CC1=O)=O)c1)c1F

InChI

InChI=1S/C20H14ClFN4O2S/c1-11-6-7-12(8-16(11)22)18(28)23-10-13-9-17(27)26-20(24-13)29-19(25-26)14-4-2-3-5-15(14)21/h2-9H,10H2,1H3,(H,23,28)

InChI Key

ZIDRSPRRCJCKMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27172557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.883

Distribution Coefficient, logD

3.882

Water Solubility, LogSw

-4.32

Polar Surface Area

62.684

Acid Dissociation Constant (pKa)

10.68

Base Dissociation Constant (pKb)

4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with F527-0681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F527-0681?
Check Price and Availability of F527-0681, 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 F527-0681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F527-0681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F527-0681
  • 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 F527-0681 available by request