G072-2457 Screening compound: 2-(4-methoxyphenoxy)-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

G072-2457 Screening compound: 2-(4-methoxyphenoxy)-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
G072-2457 Screening compound: 2-(4-methoxyphenoxy)-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 G072-2457
2-(4-methoxyphenoxy)-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

G072-2457

Molecular Formula

C19H17N5O5S2 (C19 H17 N5 O5 S2)

Compound Name

2-(4-methoxyphenoxy)-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-(4-methoxyphenoxy)-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(cc3)ccc3OC)=O)s2)=CC1=O

InChI

InChI=1S/C19H17N5O5S2/c1-11-7-15-20-12(8-17(26)24(15)29-11)10-30-19-23-22-18(31-19)21-16(25)9-28-14-5-3-13(27-2)4-6-14/h3-8H,9-10H2,1-2H3,(H,21,22,25)

InChI Key

GIOVZJSKMBDPCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27209450

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.477

Distribution Coefficient, logD

2.475

Water Solubility, LogSw

-2.79

Polar Surface Area

99.257

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

G072-2457 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with G072-2457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-2457?
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What is the minimum amount of G072-2457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-2457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-2457
  • 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 G072-2457 available by request