D090-0028 Screening compound: 8-phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole

D090-0028 Screening compound: 8-phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole
D090-0028 Screening compound: 8-phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D090-0028
8-phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole

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

D090-0028

Molecular Formula

C20H18N2 (C20 H18 N2)

Compound Name

8-phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole

IUPAC name

12-phenyl-14-diazatetracyclo[7.6.1.0^{516}.0^{1015}]hexadeca-49(16)101214-pentaene

SMILES

C(C1)CC2=NCCn3c2c1c1c3ccc(-c2ccccc2)c1

InChI

InChI=1S/C20H18N2/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18/h1-3,5-6,9-10,13H,4,7-8,11-12H2

InChI Key

WXPVMCVBNSRZQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04028018

Chemical and Physical Properties

Saltdata

CH3SO3H

Molecular Weight

286.38

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.302

Distribution Coefficient, logD

1.322

Water Solubility, LogSw

-6.08

Polar Surface Area

8.944

Acid Dissociation Constant (pKa)

21.36

Base Dissociation Constant (pKb)

11.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

D090-0028 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Others
  • Ion Channels
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with D090-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D090-0028?
Check Price and Availability of D090-0028, 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 D090-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D090-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D090-0028
  • 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 D090-0028 available by request