G642-1747 Screening compound: 2-(3-acetyl-5-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)-4-chlorophenyl acetate

G642-1747 Screening compound: 2-(3-acetyl-5-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)-4-chlorophenyl acetate
G642-1747 Screening compound: 2-(3-acetyl-5-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)-4-chlorophenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-1747
2-(3-acetyl-5-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)-4-chlorophenyl 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

G642-1747

Molecular Formula

C19H17ClN6O4 (C19 H17 ClN6 O4)

Compound Name

2-(3-acetyl-5-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)-4-chlorophenyl acetate

IUPAC name

2-(3-acetyl-5-{57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}-23-dihydro-134-oxadiazol-2-yl)-4-chlorophenyl acetate

SMILES

CC(N1N=C(c2nn3c(C)cc(C)nc3n2)OC1c(cc(cc1)Cl)c1OC(C)=O)=O

InChI

InChI=1S/C19H17ClN6O4/c1-9-7-10(2)25-19(21-9)22-16(23-25)17-24-26(11(3)27)18(30-17)14-8-13(20)5-6-15(14)29-12(4)28/h5-8,18H,1-4H3/t18-/m0/s1

InChI Key

CEGIMVROJMUOME-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15025268

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.83

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.925

Distribution Coefficient, logD

1.925

Water Solubility, LogSw

-2.92

Polar Surface Area

86.680

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

G642-1747 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G642-1747 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-1747?
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What is the minimum amount of G642-1747 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-1747
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-1747
  • 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 G642-1747 available by request