G357-2326 Screening compound: {2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate

G357-2326 Screening compound: {2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate
G357-2326 Screening compound: {2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G357-2326
{2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate

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

G357-2326

Molecular Formula

C26H24N4O4S (C26 H24 N4 O4 S)

Compound Name

{2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate

IUPAC name

{2-cyclohexyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl 3-benzamidobenzoate

SMILES

O=C(c1ccccc1)Nc1cccc(C(OCC(N=C2SC(C3CCCCC3)=NN22)=CC2=O)=O)c1

InChI

InChI=1S/C26H24N4O4S/c31-22-15-21(28-26-30(22)29-24(35-26)18-10-5-2-6-11-18)16-34-25(33)19-12-7-13-20(14-19)27-23(32)17-8-3-1-4-9-17/h1,3-4,7-9,12-15,18H,2,5-6,10-11,16H2,(H,27,32)

InChI Key

DMOPDKGOYKGJED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15002486

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.253

Distribution Coefficient, logD

5.252

Water Solubility, LogSw

-5.32

Polar Surface Area

82.412

Acid Dissociation Constant (pKa)

10.64

Base Dissociation Constant (pKb)

3.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

G357-2326 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G357-2326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G357-2326?
Check Price and Availability of G357-2326, 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 G357-2326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G357-2326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G357-2326
  • 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 G357-2326 available by request