G642-1717 Screening compound: 4-(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)phenyl acetate

G642-1717 Screening compound: 4-(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)phenyl acetate
G642-1717 Screening compound: 4-(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)phenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-1717
4-(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)phenyl 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

G642-1717

Molecular Formula

C19H18N6O4 (C19 H18 N6 O4)

Compound Name

4-(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)phenyl acetate

IUPAC name

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

SMILES

CC(N1N=C(c2nn3c(C)cc(C)nc3n2)OC1c(cc1)ccc1OC(C)=O)=O

InChI

InChI=1S/C19H18N6O4/c1-10-9-11(2)24-19(20-10)21-16(22-24)17-23-25(12(3)26)18(29-17)14-5-7-15(8-6-14)28-13(4)27/h5-9,18H,1-4H3/t18-/m0/s1

InChI Key

IOMUORKTHJXFRS-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15025264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.39

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

1.242

Distribution Coefficient, logD

1.242

Water Solubility, LogSw

-1.86

Polar Surface Area

86.593

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

G642-1717 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G642-1717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-1717?
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What is the minimum amount of G642-1717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-1717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-1717
  • 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 G642-1717 available by request