7882-2894 Screening compound: 2,5-dimethyl-N-(4H-1,2,4-triazol-3-yl)benzamide

7882-2894 Screening compound: 2,5-dimethyl-N-(4H-1,2,4-triazol-3-yl)benzamide
7882-2894 Screening compound: 2,5-dimethyl-N-(4H-1,2,4-triazol-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7882-2894
2,5-dimethyl-N-(4H-1,2,4-triazol-3-yl)benzamide

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

7882-2894

Molecular Formula

C11H12N4O (C11 H12 N4 O)

Compound Name

2,5-dimethyl-N-(4H-1,2,4-triazol-3-yl)benzamide

IUPAC name

25-dimethyl-N-(4H-124-triazol-3-yl)benzamide

SMILES

Cc1cc(C(Nc2nnc[nH]2)=O)c(C)cc1

InChI

InChI=1S/C11H12N4O/c1-7-3-4-8(2)9(5-7)10(16)14-11-12-6-13-15-11/h3-6H,1-2H3,(H2,12,13,14,15,16)

InChI Key

MOHNYTLUONKOCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05987755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.968

Distribution Coefficient, logD

0.621

Water Solubility, LogSw

-2.25

Polar Surface Area

60.167

Acid Dissociation Constant (pKa)

7.31

Base Dissociation Constant (pKb)

0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

7882-2894 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 7882-2894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7882-2894?
Check Price and Availability of 7882-2894, 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 7882-2894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7882-2894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7882-2894
  • 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 7882-2894 available by request