G357-3489 Screening compound: {5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

G357-3489 Screening compound: {5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate
G357-3489 Screening compound: {5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G357-3489
{5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

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

G357-3489

Molecular Formula

C23H19FN4O4S (C23 H19 FN4 O4 S)

Compound Name

{5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

IUPAC name

{5-oxo-2-propyl-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

SMILES

CCCC(SC1=NC(COC(c(cc2)ccc2NC(c(cc2)ccc2F)=O)=O)=C2)=NN1C2=O

InChI

InChI=1S/C23H19FN4O4S/c1-2-3-19-27-28-20(29)12-18(26-23(28)33-19)13-32-22(31)15-6-10-17(11-7-15)25-21(30)14-4-8-16(24)9-5-14/h4-12H,2-3,13H2,1H3,(H,25,30)

InChI Key

AJHQHOJJLOXCPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15002684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.298

Distribution Coefficient, logD

4.266

Water Solubility, LogSw

-4.30

Polar Surface Area

82.395

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with G357-3489 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G357-3489?
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What is the minimum amount of G357-3489 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G357-3489
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G357-3489
  • 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 G357-3489 available by request