3505-6174 Screening compound: 2,2,4,6,8-pentamethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline

3505-6174 Screening compound: 2,2,4,6,8-pentamethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline
3505-6174 Screening compound: 2,2,4,6,8-pentamethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3505-6174
2,2,4,6,8-pentamethyl-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

3505-6174

Molecular Formula

C21H25NO2S (C21 H25 NO2 S)

Compound Name

2,2,4,6,8-pentamethyl-1-(4-methylbenzenesulfonyl)-1,2-dihydroquinoline

IUPAC name

22468-pentamethyl-1-(4-methylbenzenesulfonyl)-12-dihydroquinoline

SMILES

CC(C)(C=C(C)c1c2c(C)cc(C)c1)N2S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C21H25NO2S/c1-14-7-9-18(10-8-14)25(23,24)22-20-16(3)11-15(2)12-19(20)17(4)13-21(22,5)6/h7-13H,1-6H3

InChI Key

DWBCRWOUOVOBLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01975595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.5

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

6.118

Distribution Coefficient, logD

6.118

Water Solubility, LogSw

-5.63

Polar Surface Area

32.098

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-10.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

3505-6174 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3505-6174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3505-6174?
Check Price and Availability of 3505-6174, 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 3505-6174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3505-6174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3505-6174
  • 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 3505-6174 available by request