4358-4483 Screening compound: methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate

4358-4483 Screening compound: methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate
4358-4483 Screening compound: methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4358-4483
methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate

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

4358-4483

Molecular Formula

C20H20N2O2 (C20 H20 N2 O2)

Compound Name

methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate

IUPAC name

methyl 3-[(268-trimethylquinolin-4-yl)amino]benzoate

SMILES

Cc(cc12)cc(C)c1nc(C)cc2Nc1cccc(C(OC)=O)c1

InChI

InChI=1S/C20H20N2O2/c1-12-8-13(2)19-17(9-12)18(10-14(3)21-19)22-16-7-5-6-15(11-16)20(23)24-4/h5-11H,1-4H3,(H,21,22)

InChI Key

PWPNXHIHCAUBOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016950

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

320.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.734

Distribution Coefficient, logD

3.465

Water Solubility, LogSw

-5.61

Polar Surface Area

38.534

Acid Dissociation Constant (pKa)

17.67

Base Dissociation Constant (pKb)

9.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

4358-4483 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

C-Met Library (15277 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Nervous system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4358-4483 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4358-4483?
Check Price and Availability of 4358-4483, 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 4358-4483 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4358-4483
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4358-4483
  • 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 4358-4483 available by request