G264-0003 Screening compound: {2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate

G264-0003 Screening compound: {2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate
G264-0003 Screening compound: {2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G264-0003
{2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate

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

G264-0003

Molecular Formula

C16H13FN4O4S (C16 H13 FN4 O4 S)

Compound Name

{2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate

IUPAC name

{2-methyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl 2-[(4-fluorophenyl)formamido]acetate

SMILES

CC(SC1=NC(COC(CNC(c(cc2)ccc2F)=O)=O)=C2)=NN1C2=O

InChI

InChI=1S/C16H13FN4O4S/c1-9-20-21-13(22)6-12(19-16(21)26-9)8-25-14(23)7-18-15(24)10-2-4-11(17)5-3-10/h2-6H,7-8H2,1H3,(H,18,24)

InChI Key

LTHAGAGSOIYKEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14991013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.471

Distribution Coefficient, logD

1.466

Water Solubility, LogSw

-2.37

Polar Surface Area

82.663

Acid Dissociation Constant (pKa)

11.55

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

G264-0003 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 G264-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G264-0003?
Check Price and Availability of G264-0003, 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 G264-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G264-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G264-0003
  • 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 G264-0003 available by request