8006-2755 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)-1,3-benzenediol

8006-2755 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)-1,3-benzenediol
8006-2755 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)-1,3-benzenediol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-2755
4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)-1,3-benzenediol

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

8006-2755

Molecular Formula

C22H17NO2 (C22 H17 NO2)

Compound Name

4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)-1,3-benzenediol

IUPAC name

4-{11-azatetracyclo[8.7.0.0^{27}.0^{1317}]heptadeca-1(10)2(7)3581113(17)-heptaen-12-yl}benzene-13-diol

SMILES

Oc(cc1)cc(O)c1-c1nc2ccc(cccc3)c3c2c2c1CCC2

InChI

InChI=1S/C22H17NO2/c24-14-9-10-18(20(25)12-14)22-17-7-3-6-16(17)21-15-5-2-1-4-13(15)8-11-19(21)23-22/h1-2,4-5,8-12,24-25H,3,6-7H2

InChI Key

NBKDZHMKLVUYCC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.38

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

5.579

Distribution Coefficient, logD

5.569

Water Solubility, LogSw

-6.91

Polar Surface Area

43.248

Acid Dissociation Constant (pKa)

9.07

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.64

8006-2755 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8006-2755 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-2755?
Check Price and Availability of 8006-2755, 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 8006-2755 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-2755
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-2755
  • 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 8006-2755 available by request