8014-2385 Screening compound: N~1~-[(E)-1-(4-hydroxy-3,5-dimethylanilino)ethylidene]-4-methyl-1-benzenesulfonamide

8014-2385 Screening compound: N~1~-[(E)-1-(4-hydroxy-3,5-dimethylanilino)ethylidene]-4-methyl-1-benzenesulfonamide
8014-2385 Screening compound: N~1~-[(E)-1-(4-hydroxy-3,5-dimethylanilino)ethylidene]-4-methyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-2385
N~1~-[(E)-1-(4-hydroxy-3,5-dimethylanilino)ethylidene]-4-methyl-1-benzenesulfonamide

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

8014-2385

Molecular Formula

C17H20N2O3S (C17 H20 N2 O3 S)

Compound Name

N~1~-[(E)-1-(4-hydroxy-3,5-dimethylanilino)ethylidene]-4-methyl-1-benzenesulfonamide

IUPAC name

(E)-N-(4-hydroxy-35-dimethylphenyl)-N'-(4-methylbenzenesulfonyl)ethanimidamide

SMILES

C/C(/Nc(cc1C)cc(C)c1O)=N\S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C17H20N2O3S/c1-11-5-7-16(8-6-11)23(21,22)19-14(4)18-15-9-12(2)17(20)13(3)10-15/h5-10,20H,1-4H3,(H,18,19)

InChI Key

IVOJRUKYRSKMLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02252341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.931

Distribution Coefficient, logD

2.931

Water Solubility, LogSw

-3.09

Polar Surface Area

64.020

Acid Dissociation Constant (pKa)

11.76

Base Dissociation Constant (pKb)

2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

8014-2385 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8014-2385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-2385?
Check Price and Availability of 8014-2385, 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 8014-2385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-2385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-2385
  • 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 8014-2385 available by request