8009-9547 Screening compound: 2-(2H-1,2,3-benzotriazol-2-yl)acetic acid

8009-9547 Screening compound: 2-(2H-1,2,3-benzotriazol-2-yl)acetic acid
8009-9547 Screening compound: 2-(2H-1,2,3-benzotriazol-2-yl)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-9547
2-(2H-1,2,3-benzotriazol-2-yl)acetic acid

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

8009-9547

Molecular Formula

C8H7N3O2 (C8 H7 N3 O2)

Compound Name

2-(2H-1,2,3-benzotriazol-2-yl)acetic acid

IUPAC name

2-(2H-123-benzotriazol-2-yl)acetic acid

SMILES

OC(Cn1nc(cccc2)c2n1)=O

InChI

InChI=1S/C8H7N3O2/c12-8(13)5-11-9-6-3-1-2-4-7(6)10-11/h1-4H,5H2,(H,12,13)

InChI Key

DQVKBZMURLITOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01812492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

177.16

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

-0.342

Distribution Coefficient, logD

-4.440

Water Solubility, LogSw

-1.30

Polar Surface Area

53.399

Acid Dissociation Constant (pKa)

3.30

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8009-9547 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Fragments
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8009-9547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-9547?
Check Price and Availability of 8009-9547, 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 8009-9547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-9547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-9547
  • 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 8009-9547 available by request