G768-1063 Screening compound: N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide

G768-1063 Screening compound: N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
G768-1063 Screening compound: N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G768-1063
N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-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

G768-1063

Molecular Formula

C24H22ClFN6O2S (C24 H22 ClFN6 O2 S)

Compound Name

N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-4-{[2-(2-methylphenyl)-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide

SMILES

Cc(cccc1)c1C(SC1=NC(CN(CC2)CCN2C(Nc(cc2)cc(Cl)c2F)=O)=C2)=NN1C2=O

InChI

InChI=1S/C24H22ClFN6O2S/c1-15-4-2-3-5-18(15)22-29-32-21(33)13-17(28-24(32)35-22)14-30-8-10-31(11-9-30)23(34)27-16-6-7-20(26)19(25)12-16/h2-7,12-13H,8-11,14H2,1H3,(H,27,34)

InChI Key

TZWXWOAYRKWTTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27156881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.99

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.634

Distribution Coefficient, logD

3.549

Water Solubility, LogSw

-4.10

Polar Surface Area

67.280

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G768-1063 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G768-1063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G768-1063?
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What is the minimum amount of G768-1063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G768-1063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G768-1063
  • 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 G768-1063 available by request