8015-6533 Screening compound: 2,4,6-TRIMETHYL-N-(2-PHENOXYETHYL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)BENZENE-1-SULFONAMIDE

8015-6533 Screening compound: 2,4,6-TRIMETHYL-N-(2-PHENOXYETHYL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)BENZENE-1-SULFONAMIDE
8015-6533 Screening compound: 2,4,6-TRIMETHYL-N-(2-PHENOXYETHYL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)BENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-6533
2,4,6-TRIMETHYL-N-(2-PHENOXYETHYL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)BENZENE-1-SULFONAMIDE

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

8015-6533

Molecular Formula

C18H21N5O3S (C18 H21 N5 O3 S)

Compound Name

2,4,6-TRIMETHYL-N-(2-PHENOXYETHYL)-3-(1H-1,2,3,4-TETRAZOL-1-YL)BENZENE-1-SULFONAMIDE

IUPAC name

246-trimethyl-N-(2-phenoxyethyl)-3-(1H-1234-tetrazol-1-yl)benzene-1-sulfonamide

SMILES

Cc(cc(C)c(S(NCCOc1ccccc1)(=O)=O)c1C)c1-n1nnnc1

InChI

InChI=1S/C18H21N5O3S/c1-13-11-14(2)18(15(3)17(13)23-12-19-21-22-23)27(24,25)20-9-10-26-16-7-5-4-6-8-16/h4-8,11-12,20H,9-10H2,1-3H3

InChI Key

MBAACVNYASGERO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05257400

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.647

Distribution Coefficient, logD

3.645

Water Solubility, LogSw

-3.92

Polar Surface Area

88.419

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

8015-6533 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

RAR (Nuclear receptors) Ligands Library (6524 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
Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8015-6533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-6533?
Check Price and Availability of 8015-6533, 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 8015-6533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-6533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-6533
  • 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 8015-6533 available by request