4554-6148 Screening compound: 5-methyl-11,13-dihydro-5H-5,12-diazatetracene-11,13-dione

4554-6148 Screening compound: 5-methyl-11,13-dihydro-5H-5,12-diazatetracene-11,13-dione
4554-6148 Screening compound: 5-methyl-11,13-dihydro-5H-5,12-diazatetracene-11,13-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4554-6148
5-methyl-11,13-dihydro-5H-5,12-diazatetracene-11,13-dione

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

4554-6148

Molecular Formula

C17H12N2O2 (C17 H12 N2 O2)

Compound Name

5-methyl-11,13-dihydro-5H-5,12-diazatetracene-11,13-dione

IUPAC name

5-methyl-1113-dihydro-5H-512-diazatetracene-1113-dione

SMILES

CN(c(cccc1)c1C(N12)=O)C2=Cc(cccc2)c2C1=O

InChI

InChI=1S/C17H12N2O2/c1-18-14-9-5-4-8-13(14)17(21)19-15(18)10-11-6-2-3-7-12(11)16(19)20/h2-10H,1H3

InChI Key

YORDSWSHXGPFLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03447786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.828

Distribution Coefficient, logD

1.828

Water Solubility, LogSw

-2.27

Polar Surface Area

29.678

Acid Dissociation Constant (pKa)

33.88

Base Dissociation Constant (pKb)

-6.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

4554-6148 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4554-6148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4554-6148?
Check Price and Availability of 4554-6148, 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 4554-6148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4554-6148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4554-6148
  • 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 4554-6148 available by request