G768-0588 Screening compound: 7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G768-0588 Screening compound: 7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G768-0588 Screening compound: 7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G768-0588
7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

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

G768-0588

Molecular Formula

C23H26FN5O2S (C23 H26 FN5 O2 S)

Compound Name

7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

IUPAC name

7-[(4-cyclohexanecarbonylpiperazin-1-yl)methyl]-2-(3-fluorophenyl)-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

O=C(C1CCCCC1)N1CCN(CC(N=C2SC(c3cc(F)ccc3)=NN22)=CC2=O)CC1

InChI

InChI=1S/C23H26FN5O2S/c24-18-8-4-7-17(13-18)21-26-29-20(30)14-19(25-23(29)32-21)15-27-9-11-28(12-10-27)22(31)16-5-2-1-3-6-16/h4,7-8,13-14,16H,1-3,5-6,9-12,15H2

InChI Key

VPIVFPFMAMXHTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27156666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.032

Distribution Coefficient, logD

3.019

Water Solubility, LogSw

-3.22

Polar Surface Area

58.652

Acid Dissociation Constant (pKa)

23.34

Base Dissociation Constant (pKb)

5.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with G768-0588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G768-0588?
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What is the minimum amount of G768-0588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G768-0588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G768-0588
  • 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 G768-0588 available by request