5750-0045 Screening compound: 2,2,4,7-tetramethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline

5750-0045 Screening compound: 2,2,4,7-tetramethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline
5750-0045 Screening compound: 2,2,4,7-tetramethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 5750-0045
2,2,4,7-tetramethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline

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

5750-0045

Molecular Formula

C20H23NO2S (C20 H23 NO2 S)

Compound Name

2,2,4,7-tetramethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline

IUPAC name

2247-tetramethyl-1-(4-methylbenzenesulfonyl)-12-dihydroquinoline

SMILES

CC(C)(C=C(C)c1c2cc(C)cc1)N2S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C20H23NO2S/c1-14-6-9-17(10-7-14)24(22,23)21-19-12-15(2)8-11-18(19)16(3)13-20(21,4)5/h6-13H,1-5H3

InChI Key

AVEDXUCTNRSAQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00184283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.492

Distribution Coefficient, logD

5.492

Water Solubility, LogSw

-5.55

Polar Surface Area

30.941

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-11.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

5750-0045 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Human GPCR Annotated Library (5539 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic
  • Epigenetic
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with 5750-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5750-0045?
Check Price and Availability of 5750-0045, 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 5750-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5750-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5750-0045
  • 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 5750-0045 available by request