G642-1739 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-methoxyphenyl acetate

G642-1739 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-methoxyphenyl acetate
G642-1739 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-methoxyphenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-1739
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-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

G642-1739

Molecular Formula

C20H20N6O5 (C20 H20 N6 O5)

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-methoxyphenyl acetate

IUPAC name

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

SMILES

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

InChI

InChI=1S/C20H20N6O5/c1-10-8-11(2)25-20(21-10)22-17(23-25)18-24-26(12(3)27)19(31-18)15-9-14(29-5)6-7-16(15)30-13(4)28/h6-9,19H,1-5H3/t19-/m0/s1

InChI Key

GBWVIAUSJGJVHT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD15025266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.42

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.318

Distribution Coefficient, logD

1.318

Water Solubility, LogSw

-1.90

Polar Surface Area

94.224

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

G642-1739 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G642-1739 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-1739?
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What is the minimum amount of G642-1739 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-1739
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-1739
  • 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 G642-1739 available by request