7695-1296 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-oxo-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide

7695-1296 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-oxo-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
7695-1296 Screening compound: N-(5-chloro-2-methoxyphenyl)-5-oxo-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7695-1296
N-(5-chloro-2-methoxyphenyl)-5-oxo-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide

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

7695-1296

Molecular Formula

C13H12ClN5O3 (C13 H12 ClN5 O3)

Compound Name

N-(5-chloro-2-methoxyphenyl)-5-oxo-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-5-oxo-4H5H6H7H-[124]triazolo[15-a]pyrimidine-7-carboxamide

SMILES

COc(ccc(Cl)c1)c1NC(C(C1)n2ncnc2NC1=O)=O

InChI

InChI=1S/C13H12ClN5O3/c1-22-10-3-2-7(14)4-8(10)17-12(21)9-5-11(20)18-13-15-6-16-19(9)13/h2-4,6,9H,5H2,1H3,(H,17,21)(H,15,16,18,20)/t9-/m0/s1

InChI Key

VTCVDLYLWLXTOA-VIFPVBQESA-N

MDL Number (MFCD)

MFCD06193731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.72

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.851

Distribution Coefficient, logD

0.841

Water Solubility, LogSw

-2.43

Polar Surface Area

82.547

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

7695-1296 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral HBV Library (10007 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 7695-1296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7695-1296?
Check Price and Availability of 7695-1296, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 7695-1296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7695-1296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7695-1296
  • 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 7695-1296 available by request