4964-5039 Screening compound: [2-(2H-1,3-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine

4964-5039 Screening compound: [2-(2H-1,3-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine
4964-5039 Screening compound: [2-(2H-1,3-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-5039
[2-(2H-1,3-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine

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

4964-5039

Molecular Formula

C24H24N2O2 (C24 H24 N2 O2)

Compound Name

[2-(2H-1,3-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine

IUPAC name

[2-(2H-13-benzodioxol-5-yl)ethyl][(9-ethyl-9H-carbazol-3-yl)methyl]amine

SMILES

CCn1c(ccc(CNCCc(cc2)cc3c2OCO3)c2)c2c2c1cccc2

InChI

InChI=1S/C24H24N2O2/c1-2-26-21-6-4-3-5-19(21)20-13-18(7-9-22(20)26)15-25-12-11-17-8-10-23-24(14-17)28-16-27-23/h3-10,13-14,25H,2,11-12,15-16H2,1H3

InChI Key

CNLUJCLUKUPZOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01469272

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

372.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.725

Distribution Coefficient, logD

3.547

Water Solubility, LogSw

-4.68

Polar Surface Area

29.661

Acid Dissociation Constant (pKa)

26.15

Base Dissociation Constant (pKb)

8.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

4964-5039 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4964-5039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-5039?
Check Price and Availability of 4964-5039, 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 4964-5039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-5039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-5039
  • 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 4964-5039 available by request