3389-2361 Screening compound: 1-(3,4-dichlorobenzoyl)-4-(4-ethylphenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline

3389-2361 Screening compound: 1-(3,4-dichlorobenzoyl)-4-(4-ethylphenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline
3389-2361 Screening compound: 1-(3,4-dichlorobenzoyl)-4-(4-ethylphenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3389-2361
1-(3,4-dichlorobenzoyl)-4-(4-ethylphenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline

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

3389-2361

Molecular Formula

C27H27Cl2NO (C27 H27 Cl2 NO)

Compound Name

1-(3,4-dichlorobenzoyl)-4-(4-ethylphenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline

IUPAC name

1-(34-dichlorobenzoyl)-4-(4-ethylphenyl)-224-trimethyl-1234-tetrahydroquinoline

SMILES

CCc1ccc(C(C)(CC2(C)C)c(cccc3)c3N2C(c(cc2)cc(Cl)c2Cl)=O)cc1

InChI

InChI=1S/C27H27Cl2NO/c1-5-18-10-13-20(14-11-18)27(4)17-26(2,3)30(24-9-7-6-8-21(24)27)25(31)19-12-15-22(28)23(29)16-19/h6-16H,5,17H2,1-4H3/t27-/m0/s1

InChI Key

BDKHPOPITOFTEC-MHZLTWQESA-N

MDL Number (MFCD)

MFCD01859076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.42

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.750

Distribution Coefficient, logD

7.750

Water Solubility, LogSw

-6.35

Polar Surface Area

14.053

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

-0.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

3389-2361 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3389-2361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3389-2361?
Check Price and Availability of 3389-2361, 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 3389-2361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3389-2361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3389-2361
  • 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 3389-2361 available by request