G768-0397 Screening compound: 2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G768-0397 Screening compound: 2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G768-0397 Screening compound: 2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G768-0397
2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-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

G768-0397

Molecular Formula

C24H22ClN5O3S (C24 H22 ClN5 O3 S)

Compound Name

2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

IUPAC name

2-(3-chlorophenyl)-7-{[4-(4-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

COc(cc1)ccc1C(N1CCN(CC(N=C2SC(c3cccc(Cl)c3)=NN22)=CC2=O)CC1)=O

InChI

InChI=1S/C24H22ClN5O3S/c1-33-20-7-5-16(6-8-20)23(32)29-11-9-28(10-12-29)15-19-14-21(31)30-24(26-19)34-22(27-30)17-3-2-4-18(25)13-17/h2-8,13-14H,9-12,15H2,1H3

InChI Key

XYBRLIUTJVQXBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27156591

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.99

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.930

Distribution Coefficient, logD

2.926

Water Solubility, LogSw

-3.52

Polar Surface Area

66.003

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with G768-0397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G768-0397?
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What is the minimum amount of G768-0397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G768-0397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G768-0397
  • 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 G768-0397 available by request