G357-1746 Screening compound: {3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

G357-1746 Screening compound: {3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate
G357-1746 Screening compound: {3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G357-1746
{3-methyl-5-oxo-5H-[1,3]thiazolo[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

G357-1746

Molecular Formula

C22H16FN3O4S (C22 H16 FN3 O4 S)

Compound Name

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

IUPAC name

{3-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidin-7-yl}methyl 4-(4-fluorobenzamido)benzoate

SMILES

CC(N12)=CSC2=NC(COC(c(cc2)ccc2NC(c(cc2)ccc2F)=O)=O)=CC1=O

InChI

InChI=1S/C22H16FN3O4S/c1-13-12-31-22-25-18(10-19(27)26(13)22)11-30-21(29)15-4-8-17(9-5-15)24-20(28)14-2-6-16(23)7-3-14/h2-10,12H,11H2,1H3,(H,24,28)

InChI Key

CKMCNWKBLFNSRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15002318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.333

Distribution Coefficient, logD

3.305

Water Solubility, LogSw

-3.62

Polar Surface Area

69.807

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with G357-1746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G357-1746?
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What is the minimum amount of G357-1746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G357-1746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G357-1746
  • 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 G357-1746 available by request