8011-6835 Screening compound: 5-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazole

8011-6835 Screening compound: 5-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazole
8011-6835 Screening compound: 5-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-6835
5-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazole

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

8011-6835

Molecular Formula

C9H10N4O2 (C9 H10 N4 O2)

Compound Name

5-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazole

IUPAC name

5-(34-dimethoxyphenyl)-1H-1234-tetrazole

SMILES

COc(ccc(-c1nnn[nH]1)c1)c1OC

InChI

InChI=1S/C9H10N4O2/c1-14-7-4-3-6(5-8(7)15-2)9-10-12-13-11-9/h3-5H,1-2H3,(H,10,11,12,13)

InChI Key

WMRZMZRQOCOXLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02921734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

206.2

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.023

Distribution Coefficient, logD

-1.964

Water Solubility, LogSw

-1.84

Polar Surface Area

65.612

Acid Dissociation Constant (pKa)

3.45

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8011-6835 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Pool
  • Fragments

References: we are preparing a list of scientific research reports with 8011-6835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-6835?
Check Price and Availability of 8011-6835, 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 8011-6835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-6835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-6835
  • 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 8011-6835 available by request