G768-1557 Screening compound: N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide

G768-1557 Screening compound: N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
G768-1557 Screening compound: N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G768-1557
N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-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

G768-1557

Molecular Formula

C21H19FN6O2S2 (C21 H19 FN6 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(Nc(cccc1)c1F)N1CCN(CC(N=C2SC(c3cccs3)=NN22)=CC2=O)CC1

InChI

InChI=1S/C21H19FN6O2S2/c22-15-4-1-2-5-16(15)24-20(30)27-9-7-26(8-10-27)13-14-12-18(29)28-21(23-14)32-19(25-28)17-6-3-11-31-17/h1-6,11-12H,7-10,13H2,(H,24,30)

InChI Key

NHWFCRHGRANAOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27157153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.55

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

2.684

Distribution Coefficient, logD

2.599

Water Solubility, LogSw

-3.09

Polar Surface Area

67.601

Acid Dissociation Constant (pKa)

12.14

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G768-1557 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 G768-1557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G768-1557?
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What is the minimum amount of G768-1557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G768-1557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G768-1557
  • 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 G768-1557 available by request