G642-1559 Screening compound: 4-{3-acetyl-5-[1-(4-acetamido-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-2-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl}-2-methoxyphenyl acetate

G642-1559 Screening compound: 4-{3-acetyl-5-[1-(4-acetamido-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-2-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl}-2-methoxyphenyl acetate
G642-1559 Screening compound: 4-{3-acetyl-5-[1-(4-acetamido-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-2-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl}-2-methoxyphenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-1559
4-{3-acetyl-5-[1-(4-acetamido-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-2-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl}-2-methoxyphenyl 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

G642-1559

Molecular Formula

C21H22N8O7 (C21 H22 N8 O7)

Compound Name

4-{3-acetyl-5-[1-(4-acetamido-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-2-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl}-2-methoxyphenyl acetate

IUPAC name

4-{3-acetyl-5-[1-(4-acetamido-125-oxadiazol-3-yl)-5-methyl-1H-123-triazol-4-yl]-2-methyl-23-dihydro-134-oxadiazol-2-yl}-2-methoxyphenyl acetate

SMILES

CC1(c(cc2)cc(OC)c2OC(C)=O)OC(c2c(C)n(-c3nonc3NC(C)=O)nn2)=NN1C(C)=O

InChI

InChI=1S/C21H22N8O7/c1-10-17(23-27-28(10)19-18(22-11(2)30)25-36-26-19)20-24-29(12(3)31)21(5,35-20)14-7-8-15(34-13(4)32)16(9-14)33-6/h7-9H,1-6H3,(H,22,25,30)/t21-/m0/s1

InChI Key

OIWJUJMTBBVBDF-NRFANRHFSA-N

MDL Number (MFCD)

MFCD15025221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.46

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

15

Partition Coefficient, logP

1.068

Distribution Coefficient, logD

-0.625

Water Solubility, LogSw

-2.05

Polar Surface Area

149.146

Acid Dissociation Constant (pKa)

5.72

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with G642-1559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-1559?
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What is the minimum amount of G642-1559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-1559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-1559
  • 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 G642-1559 available by request