K906-3089 Screening compound: 5-[(1E)-2-(dimethylamino)ethenyl]-N,3-dimethyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-sulfonamide

K906-3089 Screening compound: 5-[(1E)-2-(dimethylamino)ethenyl]-N,3-dimethyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-sulfonamide
K906-3089 Screening compound: 5-[(1E)-2-(dimethylamino)ethenyl]-N,3-dimethyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-3089
5-[(1E)-2-(dimethylamino)ethenyl]-N,3-dimethyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-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

K906-3089

Molecular Formula

C17H23N3O3S (C17 H23 N3 O3 S)

Compound Name

5-[(1E)-2-(dimethylamino)ethenyl]-N,3-dimethyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-sulfonamide

IUPAC name

5-[(1E)-2-(dimethylamino)ethenyl]-N3-dimethyl-N-[(4-methylphenyl)methyl]-12-oxazole-4-sulfonamide

SMILES

Cc1noc(/C=C/N(C)C)c1S(N(C)Cc1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C17H23N3O3S/c1-13-6-8-15(9-7-13)12-20(5)24(21,22)17-14(2)18-23-16(17)10-11-19(3)4/h6-11H,12H2,1-5H3

InChI Key

LPQQBLSKUQSJBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15113160

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.864

Distribution Coefficient, logD

1.863

Water Solubility, LogSw

-2.34

Polar Surface Area

58.088

Acid Dissociation Constant (pKa)

27.97

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

K906-3089 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with K906-3089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-3089?
Check Price and Availability of K906-3089, 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 K906-3089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-3089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-3089
  • 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 K906-3089 available by request