G265-0356 Screening compound: {2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2H-1,3-benzodioxole-5-carboxylate

G265-0356 Screening compound: {2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2H-1,3-benzodioxole-5-carboxylate
G265-0356 Screening compound: {2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2H-1,3-benzodioxole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G265-0356
{2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2H-1,3-benzodioxole-5-carboxylate

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

G265-0356

Molecular Formula

C17H13N3O5S (C17 H13 N3 O5 S)

Compound Name

{2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2H-1,3-benzodioxole-5-carboxylate

IUPAC name

{2-cyclopropyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl 2H-13-benzodioxole-5-carboxylate

SMILES

O=C(c(cc1)cc2c1OCO2)OCC(N=C1SC(C2CC2)=NN11)=CC1=O

InChI

InChI=1S/C17H13N3O5S/c21-14-6-11(18-17-20(14)19-15(26-17)9-1-2-9)7-23-16(22)10-3-4-12-13(5-10)25-8-24-12/h3-6,9H,1-2,7-8H2

InChI Key

CMSXFSACKSMIIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14991351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.952

Distribution Coefficient, logD

2.945

Water Solubility, LogSw

-3.33

Polar Surface Area

76.767

Acid Dissociation Constant (pKa)

22.41

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G265-0356 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G265-0356 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G265-0356?
Check Price and Availability of G265-0356, 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 G265-0356 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G265-0356
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G265-0356
  • 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 G265-0356 available by request