P713-0793 Screening compound: N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl}acetamide

P713-0793 Screening compound: N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl}acetamide
P713-0793 Screening compound: N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P713-0793
N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-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

P713-0793

Molecular Formula

C21H22N6O2 (C21 H22 N6 O2)

Compound Name

N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl}acetamide

IUPAC name

N-[(2-methylphenyl)methyl]-2-{7-[3-(propan-2-yl)-124-oxadiazol-5-yl]-[124]triazolo[43-a]pyridin-3-yl}acetamide

SMILES

CC(C)c1noc(-c2cc3nnc(CC(NCc4c(C)cccc4)=O)n3cc2)n1

InChI

InChI=1S/C21H22N6O2/c1-13(2)20-23-21(29-26-20)15-8-9-27-17(10-15)24-25-18(27)11-19(28)22-12-16-7-5-4-6-14(16)3/h4-10,13H,11-12H2,1-3H3,(H,22,28)

InChI Key

JGIRBIKVGVLXEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.126

Distribution Coefficient, logD

3.126

Water Solubility, LogSw

-3.11

Polar Surface Area

78.702

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

P713-0793 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 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 P713-0793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P713-0793?
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What is the minimum amount of P713-0793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P713-0793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P713-0793
  • 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 P713-0793 available by request