8010-3851 Screening compound: 8-(3,4,5-trimethoxyphenyl)-7H,8H,9H,10H,11H,12H-cyclohexa[a]4,7-phenanthrolin-9-one

8010-3851 Screening compound: 8-(3,4,5-trimethoxyphenyl)-7H,8H,9H,10H,11H,12H-cyclohexa[a]4,7-phenanthrolin-9-one
8010-3851 Screening compound: 8-(3,4,5-trimethoxyphenyl)-7H,8H,9H,10H,11H,12H-cyclohexa[a]4,7-phenanthrolin-9-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3851
8-(3,4,5-trimethoxyphenyl)-7H,8H,9H,10H,11H,12H-cyclohexa[a]4,7-phenanthrolin-9-one

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

8010-3851

Molecular Formula

C25H24N2O4 (C25 H24 N2 O4)

Compound Name

8-(3,4,5-trimethoxyphenyl)-7H,8H,9H,10H,11H,12H-cyclohexa[a]4,7-phenanthrolin-9-one

IUPAC name

8-(345-trimethoxyphenyl)-7H8H9H10H11H12H-cyclohexa[a]47-phenanthrolin-9-one

SMILES

COc1cc(C(C2=C3CCCC2=O)Nc2c3c3cccnc3cc2)cc(OC)c1OC

InChI

InChI=1S/C25H24N2O4/c1-29-20-12-14(13-21(30-2)25(20)31-3)24-23-16(6-4-8-19(23)28)22-15-7-5-11-26-17(15)9-10-18(22)27-24/h5,7,9-13,24,27H,4,6,8H2,1-3H3/t24-/m0/s1

InChI Key

GASKQNWQRLWRHG-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD01872186

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.947

Distribution Coefficient, logD

3.946

Water Solubility, LogSw

-4.44

Polar Surface Area

56.944

Acid Dissociation Constant (pKa)

15.77

Base Dissociation Constant (pKb)

3.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

8010-3851 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8010-3851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3851?
Check Price and Availability of 8010-3851, 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 8010-3851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3851
  • 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 8010-3851 available by request