G357-0913 Screening compound: [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate

G357-0913 Screening compound: [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate
G357-0913 Screening compound: [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G357-0913
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate

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

G357-0913

Molecular Formula

C18H20N4O5S2 (C18 H20 N4 O5 S2)

Compound Name

[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate

IUPAC name

[2-(2-methylpropyl)-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl]methyl 3-methanesulfonamidobenzoate

SMILES

CC(C)CC(SC1=NC(COC(c2cccc(NS(C)(=O)=O)c2)=O)=C2)=NN1C2=O

InChI

InChI=1S/C18H20N4O5S2/c1-11(2)7-15-20-22-16(23)9-14(19-18(22)28-15)10-27-17(24)12-5-4-6-13(8-12)21-29(3,25)26/h4-6,8-9,11,21H,7,10H2,1-3H3

InChI Key

HAUBICWKOPHYPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15002045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.833

Distribution Coefficient, logD

2.816

Water Solubility, LogSw

-3.46

Polar Surface Area

101.171

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

5.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G357-0913 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G357-0913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G357-0913?
Check Price and Availability of G357-0913, 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 G357-0913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G357-0913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G357-0913
  • 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 G357-0913 available by request