2810-4196 Screening compound: 2-(4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-amine

2810-4196 Screening compound: 2-(4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-amine
2810-4196 Screening compound: 2-(4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2810-4196
2-(4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-amine

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

2810-4196

Molecular Formula

C13H12N4O (C13 H12 N4 O)

Compound Name

2-(4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-amine

IUPAC name

2-(4-methoxyphenyl)-2H-123-benzotriazol-5-amine

SMILES

COc(cc1)ccc1-n1nc(cc(cc2)N)c2n1

InChI

InChI=1S/C13H12N4O/c1-18-11-5-3-10(4-6-11)17-15-12-7-2-9(14)8-13(12)16-17/h2-8H,14H2,1H3

InChI Key

WNZKUNXGRZGIFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00434232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.375

Distribution Coefficient, logD

2.375

Water Solubility, LogSw

-2.64

Polar Surface Area

52.622

Acid Dissociation Constant (pKa)

20.06

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

2810-4196 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2810-4196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2810-4196?
Check Price and Availability of 2810-4196, 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 2810-4196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2810-4196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2810-4196
  • 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 2810-4196 available by request