S400-0023 Screening compound: 4-{[(1E)-1H-inden-1-ylidene]methyl}-N,N-dimethylaniline

S400-0023 Screening compound: 4-{[(1E)-1H-inden-1-ylidene]methyl}-N,N-dimethylaniline
S400-0023 Screening compound: 4-{[(1E)-1H-inden-1-ylidene]methyl}-N,N-dimethylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound S400-0023
4-{[(1E)-1H-inden-1-ylidene]methyl}-N,N-dimethylaniline

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

S400-0023

Molecular Formula

C18H17N (C18 H17 N)

Compound Name

4-{[(1E)-1H-inden-1-ylidene]methyl}-N,N-dimethylaniline

IUPAC name

4-{[(1E)-1H-inden-1-ylidene]methyl}-NN-dimethylaniline

SMILES

CN(C)c1ccc(/C=C(\C=C2)/c3c2cccc3)cc1

InChI

InChI=1S/C18H17N/c1-19(2)17-11-7-14(8-12-17)13-16-10-9-15-5-3-4-6-18(15)16/h3-13H,1-2H3

InChI Key

HXVZHTQDVDNJMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00805178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.34

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

4.417

Distribution Coefficient, logD

4.417

Water Solubility, LogSw

-4.56

Polar Surface Area

3.058

Acid Dissociation Constant (pKa)

30.86

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

S400-0023 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Human Phosphatases Annotated Library (206 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with S400-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S400-0023?
Check Price and Availability of S400-0023, 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 S400-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S400-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S400-0023
  • 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 S400-0023 available by request