0820-0895 Screening compound: 4-{1H,2H,3H,4H-benzo[a]phenanthridin-5-yl}benzene-1,2-diol

0820-0895 Screening compound: 4-{1H,2H,3H,4H-benzo[a]phenanthridin-5-yl}benzene-1,2-diol
0820-0895 Screening compound: 4-{1H,2H,3H,4H-benzo[a]phenanthridin-5-yl}benzene-1,2-diol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0820-0895
4-{1H,2H,3H,4H-benzo[a]phenanthridin-5-yl}benzene-1,2-diol

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

0820-0895

Molecular Formula

C23H19NO2 (C23 H19 NO2)

Compound Name

4-{1H,2H,3H,4H-benzo[a]phenanthridin-5-yl}benzene-1,2-diol

IUPAC name

4-{1H2H3H4H-benzo[a]phenanthridin-5-yl}benzene-12-diol

SMILES

Oc(ccc(-c1nc2ccc(cccc3)c3c2c2c1CCCC2)c1)c1O

InChI

InChI=1S/C23H19NO2/c25-20-12-10-15(13-21(20)26)23-18-8-4-3-7-17(18)22-16-6-2-1-5-14(16)9-11-19(22)24-23/h1-2,5-6,9-13,25-26H,3-4,7-8H2

InChI Key

IMWNOAJRQNURFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00363369

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.669

Distribution Coefficient, logD

5.618

Water Solubility, LogSw

-6.89

Polar Surface Area

41.813

Acid Dissociation Constant (pKa)

8.38

Base Dissociation Constant (pKb)

5.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 0820-0895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0820-0895?
Check Price and Availability of 0820-0895, 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 0820-0895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0820-0895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0820-0895
  • 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 0820-0895 available by request