G072-2458 Screening compound: 2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide

G072-2458 Screening compound: 2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
G072-2458 Screening compound: 2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-2458
2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide

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

G072-2458

Molecular Formula

C18H14FN5O4S2 (C18 H14 FN5 O4 S2)

Compound Name

2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide

IUPAC name

2-(2-fluorophenoxy)-N-{5-[({2-methyl-7-oxo-7H-[12]oxazolo[23-a]pyrimidin-5-yl}methyl)sulfanyl]-134-thiadiazol-2-yl}acetamide

SMILES

CC(ON12)=CC2=NC(CSc2nnc(NC(COc(cccc3)c3F)=O)s2)=CC1=O

InChI

InChI=1S/C18H14FN5O4S2/c1-10-6-14-20-11(7-16(26)24(14)28-10)9-29-18-23-22-17(30-18)21-15(25)8-27-13-5-3-2-4-12(13)19/h2-7H,8-9H2,1H3,(H,21,22,25)

InChI Key

POIUJIXOINOEBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.572

Distribution Coefficient, logD

2.571

Water Solubility, LogSw

-2.99

Polar Surface Area

91.800

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with G072-2458 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-2458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-2458
  • 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 G072-2458 available by request